4-[[5-oxidanylidene-6-[2-(4-phenylpiperidin-1-yl)ethyl]-7,8-dihydro-6H-naphthalen-2-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[5-oxidanylidene-6-[2-(4-phenylpiperidin-1-yl)ethyl]-7,8-dihydro-6H-naphthalen-2-yl]oxymethyl]benzoic acid Openeye Name: 4-[[1-oxo-2-[2-(4-phenyl-1-piperidyl)ethyl]tetralin-6-yl]oxymethyl]benzoic acid CAS Name: 4-[[5-oxo-6-[2-(4-phenyl-1-piperidinyl)ethyl]-7,8-dihydro-6H-naphthalen-2-yl]oxymethyl]benzoic acid IUPAC Name: 4-[[5-oxo-6-[2-(4-phenylpiperidin-1-yl)ethyl]-7,8-dihydro-6H-naphthalen-2-yl]oxymethyl]benzoic acid Traditional Name: 4-[[1-keto-2-[2-(4-phenylpiperidino)ethyl]tetralin-6-yl]oxymethyl]benzoic acid Formula: C31H33NO4 MolecularWeight: 483.59802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)OCC3=CC=C(C=C3)C(=O)O)C(=O)C1CCN4CCC(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C=CC(=C2)OCC3=CC=C(C=C3)C(=O)O)C(=O)C1CCN4CCC(CC4)C5=CC=CC=C5

InChI

InChI=1S/C31H33NO4/c33-30-25(16-19-32-17-14-24(15-18-32)23-4-2-1-3-5-23)10-11-27-20-28(12-13-29(27)30)36-21-22-6-8-26(9-7-22)31(34)35/h1-9,12-13,20,24-25H,10-11,14-19,21H2,(H,34,35)