(phenylmethyl) 2-(3-azanyl-2-oxidanylidene-azepan-1-yl)ethanoate hydrochloride

Systemtic Name: (phenylmethyl) 2-(3-azanyl-2-oxidanylidene-azepan-1-yl)ethanoate hydrochloride Openeye Name: benzyl 2-(3-amino-2-oxo-azepan-1-yl)acetate hydrochloride CAS Name: 2-(3-amino-2-oxo-1-azepanyl)acetic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 2-(3-amino-2-oxoazepan-1-yl)acetate hydrochloride Traditional Name: 2-(3-amino-2-keto-azepan-1-yl)acetic acid benzyl ester hydrochloride Formula: C15H21ClN2O3 MolecularWeight: 312.79184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)N)CC(=O)OCC2=CC=CC=C2.Cl

Isomeric SMILES

C1CCN(C(=O)C(C1)N)CC(=O)OCC2=CC=CC=C2.Cl

InChI

InChI=1S/C15H20N2O3.ClH/c16-13-8-4-5-9-17(15(13)19)10-14(18)20-11-12-6-2-1-3-7-12;/h1-3,6-7,13H,4-5,8-11,16H2;1H