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

Systemtic Name: 2-oxidanyl-4-[2-oxidanyl-2-oxidanylidene-1-[[phenyl-(2-piperidin-1-ylphenyl)methyl]amino]ethyl]benzoic acid Openeye Name: 2-hydroxy-4-[2-hydroxy-2-oxo-1-[[phenyl-[2-(1-piperidyl)phenyl]methyl]amino]ethyl]benzoic acid CAS Name: 2-hydroxy-4-[2-hydroxy-2-oxo-1-[[phenyl-[2-(1-piperidinyl)phenyl]methyl]amino]ethyl]benzoic acid IUPAC Name: 2-hydroxy-4-[2-hydroxy-2-oxo-1-[[phenyl-(2-piperidin-1-ylphenyl)methyl]amino]ethyl]benzoic acid Traditional Name: 2-hydroxy-4-[2-hydroxy-2-keto-1-[[phenyl-(2-piperidinophenyl)methyl]amino]ethyl]benzoic acid Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O5/c30-23-17-19(13-14-21(23)26(31)32)25(27(33)34)28-24(18-9-3-1-4-10-18)20-11-5-6-12-22(20)29-15-7-2-8-16-29/h1,3-6,9-14,17,24-25,28,30H,2,7-8,15-16H2,(H,31,32)(H,33,34)