heptyl 4-azanyl-3-phenyl-butanoate hydrochloride

Systemtic Name: heptyl 4-azanyl-3-phenyl-butanoate hydrochloride Openeye Name: heptyl 4-amino-3-phenyl-butanoate hydrochloride CAS Name: 4-amino-3-phenylbutanoic acid heptyl ester hydrochloride IUPAC Name: heptyl 4-amino-3-phenylbutanoate hydrochloride Traditional Name: 4-amino-3-phenyl-butyric acid heptyl ester hydrochloride Formula: C17H28ClNO2 MolecularWeight: 313.86272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)CC(CN)C1=CC=CC=C1.Cl

Isomeric SMILES

CCCCCCCOC(=O)CC(CN)C1=CC=CC=C1.Cl

InChI

InChI=1S/C17H27NO2.ClH/c1-2-3-4-5-9-12-20-17(19)13-16(14-18)15-10-7-6-8-11-15;/h6-8,10-11,16H,2-5,9,12-14,18H2,1H3;1H