2-azanyl-3-[4-(4-oxidanylidene-4-phenyl-butyl)piperidin-1-yl]carbonyl-benzoic acid

Systemtic Name: 2-azanyl-3-[4-(4-oxidanylidene-4-phenyl-butyl)piperidin-1-yl]carbonyl-benzoic acid Openeye Name: 2-amino-3-[4-(4-oxo-4-phenyl-butyl)piperidine-1-carbonyl]benzoic acid CAS Name: 2-amino-3-[oxo-[4-(4-oxo-4-phenylbutyl)-1-piperidinyl]methyl]benzoic acid IUPAC Name: 2-amino-3-[4-(4-oxo-4-phenylbutyl)piperidine-1-carbonyl]benzoic acid Traditional Name: 2-amino-3-[4-(4-keto-4-phenyl-butyl)piperidine-1-carbonyl]benzoic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCC(=O)C2=CC=CC=C2)C(=O)C3=C(C(=CC=C3)C(=O)O)N

Isomeric SMILES

C1CN(CCC1CCCC(=O)C2=CC=CC=C2)C(=O)C3=C(C(=CC=C3)C(=O)O)N

InChI

InChI=1S/C23H26N2O4/c24-21-18(9-5-10-19(21)23(28)29)22(27)25-14-12-16(13-15-25)6-4-11-20(26)17-7-2-1-3-8-17/h1-3,5,7-10,16H,4,6,11-15,24H2,(H,28,29)