2-(phenylmethyl)azepane-2-carboxylic acid hydrochloride

Systemtic Name: 2-(phenylmethyl)azepane-2-carboxylic acid hydrochloride Openeye Name: 2-benzylazepane-2-carboxylic acid hydrochloride CAS Name: 2-(phenylmethyl)-2-azepanecarboxylic acid hydrochloride IUPAC Name: 2-benzylazepane-2-carboxylic acid hydrochloride Traditional Name: 2-benzylazepane-2-carboxylic acid hydrochloride Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(NCC1)(CC2=CC=CC=C2)C(=O)O.Cl

Isomeric SMILES

C1CCC(NCC1)(CC2=CC=CC=C2)C(=O)O.Cl

InChI

InChI=1S/C14H19NO2.ClH/c16-13(17)14(9-5-2-6-10-15-14)11-12-7-3-1-4-8-12;/h1,3-4,7-8,15H,2,5-6,9-11H2,(H,16,17);1H