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

Systemtic Name: 4-[1-azanyl-1-oxidanylidene-3-phenyl-3-(2-piperidin-1-ylphenyl)propan-2-yl]benzoic acid Openeye Name: 4-[1-carbamoyl-2-phenyl-2-[2-(1-piperidyl)phenyl]ethyl]benzoic acid CAS Name: 4-[1-amino-1-oxo-3-phenyl-3-[2-(1-piperidinyl)phenyl]propan-2-yl]benzoic acid IUPAC Name: 4-[1-amino-1-oxo-3-phenyl-3-(2-piperidin-1-ylphenyl)propan-2-yl]benzoic acid Traditional Name: 4-[1-carbamoyl-2-phenyl-2-(2-piperidinophenyl)ethyl]benzoic acid Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC=C2C(C3=CC=CC=C3)C(C4=CC=C(C=C4)C(=O)O)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2C(C3=CC=CC=C3)C(C4=CC=C(C=C4)C(=O)O)C(=O)N

InChI

InChI=1S/C27H28N2O3/c28-26(30)25(20-13-15-21(16-14-20)27(31)32)24(19-9-3-1-4-10-19)22-11-5-6-12-23(22)29-17-7-2-8-18-29/h1,3-6,9-16,24-25H,2,7-8,17-18H2,(H2,28,30)(H,31,32)