2-[(2-oxidanylidene-6-phenyl-azepan-3-yl)amino]-4-phenyl-butanoic acid

Systemtic Name: 2-[(2-oxidanylidene-6-phenyl-azepan-3-yl)amino]-4-phenyl-butanoic acid Openeye Name: 2-[(2-oxo-6-phenyl-azepan-3-yl)amino]-4-phenyl-butanoic acid CAS Name: 2-[(2-oxo-6-phenyl-3-azepanyl)amino]-4-phenylbutanoic acid IUPAC Name: 2-[(2-oxo-6-phenylazepan-3-yl)amino]-4-phenylbutanoic acid Traditional Name: 2-[(2-keto-6-phenyl-azepan-3-yl)amino]-4-phenyl-butyric acid Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NCC1C2=CC=CC=C2)NC(CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(C(=O)NCC1C2=CC=CC=C2)NC(CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H26N2O3/c25-21-19(14-12-18(15-23-21)17-9-5-2-6-10-17)24-20(22(26)27)13-11-16-7-3-1-4-8-16/h1-10,18-20,24H,11-15H2,(H,23,25)(H,26,27)