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

Systemtic Name: 4-[2-oxidanylidene-2-[[phenyl-(2-piperidin-1-ylphenyl)methyl]amino]ethyl]-2-propoxy-benzoic acid Openeye Name: 4-[2-oxo-2-[[phenyl-[2-(1-piperidyl)phenyl]methyl]amino]ethyl]-2-propoxy-benzoic acid CAS Name: 4-[2-oxo-2-[[phenyl-[2-(1-piperidinyl)phenyl]methyl]amino]ethyl]-2-propoxybenzoic acid IUPAC Name: 4-[2-oxo-2-[[phenyl-(2-piperidin-1-ylphenyl)methyl]amino]ethyl]-2-propoxybenzoic acid Traditional Name: 4-[2-keto-2-[[phenyl-(2-piperidinophenyl)methyl]amino]ethyl]-2-propoxy-benzoic acid Formula: C30H34N2O4 MolecularWeight: 486.60196

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3N4CCCCC4)C(=O)O

Isomeric SMILES

CCCOC1=C(C=CC(=C1)CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3N4CCCCC4)C(=O)O

InChI

InChI=1S/C30H34N2O4/c1-2-19-36-27-20-22(15-16-25(27)30(34)35)21-28(33)31-29(23-11-5-3-6-12-23)24-13-7-8-14-26(24)32-17-9-4-10-18-32/h3,5-8,11-16,20,29H,2,4,9-10,17-19,21H2,1H3,(H,31,33)(H,34,35)