4-[2-oxidanylidene-2-[[(R)-phenyl-(2-piperidin-1-ylphenyl)methyl]amino]ethyl]benzoic acid

Systemtic Name: 4-[2-oxidanylidene-2-[[(R)-phenyl-(2-piperidin-1-ylphenyl)methyl]amino]ethyl]benzoic acid Openeye Name: 4-[2-oxo-2-[[(R)-phenyl-[2-(1-piperidyl)phenyl]methyl]amino]ethyl]benzoic acid CAS Name: 4-[2-oxo-2-[[(R)-phenyl-[2-(1-piperidinyl)phenyl]methyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-oxo-2-[[(R)-phenyl-(2-piperidin-1-ylphenyl)methyl]amino]ethyl]benzoic acid Traditional Name: 4-[2-keto-2-[[(R)-phenyl-(2-piperidinophenyl)methyl]amino]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)NC(=O)CC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2[C@@H](C3=CC=CC=C3)NC(=O)CC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C27H28N2O3/c30-25(19-20-13-15-22(16-14-20)27(31)32)28-26(21-9-3-1-4-10-21)23-11-5-6-12-24(23)29-17-7-2-8-18-29/h1,3-6,9-16,26H,2,7-8,17-19H2,(H,28,30)(H,31,32)/t26-/m1/s1