ethyl 2-acetamido-4-(2-oxidanylidene-5-phenyl-azepan-1-yl)butanoate

Systemtic Name: ethyl 2-acetamido-4-(2-oxidanylidene-5-phenyl-azepan-1-yl)butanoate Openeye Name: ethyl 2-acetamido-4-(2-oxo-5-phenyl-azepan-1-yl)butanoate CAS Name: 2-acetamido-4-(2-oxo-5-phenyl-1-azepanyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-4-(2-oxo-5-phenylazepan-1-yl)butanoate Traditional Name: 2-acetamido-4-(2-keto-5-phenyl-azepan-1-yl)butyric acid ethyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCN1CCC(CCC1=O)C2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCN1CCC(CCC1=O)C2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C20H28N2O4/c1-3-26-20(25)18(21-15(2)23)12-14-22-13-11-17(9-10-19(22)24)16-7-5-4-6-8-16/h4-8,17-18H,3,9-14H2,1-2H3,(H,21,23)