912762-91-5 Purity
---
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C15H24N2O4.
The molecular weight is 296.36 g/mol.
The IUPAC name is tert-butyl N-[2-amino-2-(2,4-dimethoxyphenyl)ethyl]carbamate.
The InChI is InChI=1S/C15H24N2O4/c1-15(2,3)21-14(18)17-9-12(16)11-7-6-10(19-4)8-13(11)20-5/h6-8,12H,9,16H2,1-5H3,(H,17,18).
The InChIKey is ZGJWJSYPOVKKER-UHFFFAOYSA-N.
The canonical SMILES is CC(C)(C)OC(=O)NCC(C1=C(C=C(C=C1)OC)OC)N.
There are 2 hydrogen bond donor counts.
There are 5 hydrogen bond acceptor counts.
There are 7 rotatable bond counts.
Yes, the compound is canonicalized.