butyl 2-[(2-oxidanylidene-6-phenyl-azepan-3-yl)amino]-4-phenyl-butanoate

Systemtic Name: butyl 2-[(2-oxidanylidene-6-phenyl-azepan-3-yl)amino]-4-phenyl-butanoate Openeye Name: butyl 2-[(2-oxo-6-phenyl-azepan-3-yl)amino]-4-phenyl-butanoate CAS Name: 2-[(2-oxo-6-phenyl-3-azepanyl)amino]-4-phenylbutanoic acid butyl ester IUPAC Name: butyl 2-[(2-oxo-6-phenylazepan-3-yl)amino]-4-phenylbutanoate Traditional Name: 2-[(2-keto-6-phenyl-azepan-3-yl)amino]-4-phenyl-butyric acid butyl ester Formula: C26H34N2O3 MolecularWeight: 422.55976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CCC1=CC=CC=C1)NC2CCC(CNC2=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C(CCC1=CC=CC=C1)NC2CCC(CNC2=O)C3=CC=CC=C3

InChI

InChI=1S/C26H34N2O3/c1-2-3-18-31-26(30)24(16-14-20-10-6-4-7-11-20)28-23-17-15-22(19-27-25(23)29)21-12-8-5-9-13-21/h4-13,22-24,28H,2-3,14-19H2,1H3,(H,27,29)