6-[3-(Dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzothiepine-5-carbonitrile; 2-hydroxy-2-oxoacetate

CAS

87033-51-0

Catalog Number

ACM87033510

Category

Other Products

Molecular Weight

411.494 g/mol

Molecular Formula

C₂₂H₂₃N₂O₄S-

MSDS COA Spec Sheet

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Specification

IUPAC Name

6-[3-(dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzothiepine-5-carbonitrile;2-hydroxy-2-oxoacetate

Canonical SMILES

CN(C)CCCC1C(C2=CC=CC=C2SC3=CC=CC=C13)C#N.C(=O)(C(=O)[O-])O

InChI Key

YNWDETZEXVPRAI-UHFFFAOYSA-M

Exact Mass

411.13800

H-Bond Acceptor

H-Bond Donor

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