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Structure

3-(1-Cyano-1-methylethyl)-5-methoxy-1H-indole-1-carboxylic acid 1,1-dimethylethyl ester

CAS
907602-77-1
Catalog Number
ACM907602771
Category
Other Products
Molecular Formula
C18H22N2O3

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Specification

Synonyms
1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester
What is the molecular formula of the compound with PubChem CID 71464018?

The molecular formula is C18H22N2O3.

When was the compound created in PubChem?

The compound was created on May 31, 2013.

What is the IUPAC Name of the compound?

The IUPAC Name is tert-butyl 3-(2-cyanopropan-2-yl)-5-methoxyindole-1-carboxylate.

What is the molecular weight of the compound?

The molecular weight is 314.4 g/mol.

How many hydrogen bond acceptor counts does the compound have?

The compound has 4 hydrogen bond acceptor counts.

What is the Exact Mass of the compound?

The Exact Mass is 314.16304257 g/mol.

How many rotatable bond counts does the compound have?

The compound has 4 rotatable bond counts.

Is the compound's structure canonicalized?

Yes, the compound's structure is canonicalized.

What is the InChIKey of the compound?

The InChIKey is YIESVYJWQYZJPD-UHFFFAOYSA-N.

How many covalently-bonded unit counts does the compound have?

The compound has 1 covalently-bonded unit count.

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