4-[2-oxidanylidene-2-[1-(2-piperidin-1-ylphenyl)butylamino]ethyl]-2-phenylmethoxy-benzoic acid

Systemtic Name: 4-[2-oxidanylidene-2-[1-(2-piperidin-1-ylphenyl)butylamino]ethyl]-2-phenylmethoxy-benzoic acid Openeye Name: 2-benzyloxy-4-[2-oxo-2-[1-[2-(1-piperidyl)phenyl]butylamino]ethyl]benzoic acid CAS Name: 4-[2-oxo-2-[1-[2-(1-piperidinyl)phenyl]butylamino]ethyl]-2-phenylmethoxybenzoic acid IUPAC Name: 4-[2-oxo-2-[1-(2-piperidin-1-ylphenyl)butylamino]ethyl]-2-phenylmethoxybenzoic acid Traditional Name: 2-benzoxy-4-[2-keto-2-[1-(2-piperidinophenyl)butylamino]ethyl]benzoic acid Formula: C31H36N2O4 MolecularWeight: 500.62854

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H36N2O4/c1-2-11-27(25-14-7-8-15-28(25)33-18-9-4-10-19-33)32-30(34)21-24-16-17-26(31(35)36)29(20-24)37-22-23-12-5-3-6-13-23/h3,5-8,12-17,20,27H,2,4,9-11,18-19,21-22H2,1H3,(H,32,34)(H,35,36)