4-[2-[[2-cycloheptyl-1-(2-piperidin-1-ylphenyl)ethyl]amino]-2-oxidanylidene-ethyl]-2-ethoxy-benzoic acid

Systemtic Name: 4-[2-[[2-cycloheptyl-1-(2-piperidin-1-ylphenyl)ethyl]amino]-2-oxidanylidene-ethyl]-2-ethoxy-benzoic acid Openeye Name: 4-[2-[[2-cycloheptyl-1-[2-(1-piperidyl)phenyl]ethyl]amino]-2-oxo-ethyl]-2-ethoxy-benzoic acid CAS Name: 4-[2-[[2-cycloheptyl-1-[2-(1-piperidinyl)phenyl]ethyl]amino]-2-oxoethyl]-2-ethoxybenzoic acid IUPAC Name: 4-[2-[[2-cycloheptyl-1-(2-piperidin-1-ylphenyl)ethyl]amino]-2-oxoethyl]-2-ethoxybenzoic acid Traditional Name: 4-[2-[[2-cycloheptyl-1-(2-piperidinophenyl)ethyl]amino]-2-keto-ethyl]-2-ethoxy-benzoic acid Formula: C31H42N2O4 MolecularWeight: 506.67618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC(=O)NC(CC2CCCCCC2)C3=CC=CC=C3N4CCCCC4)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC(=O)NC(CC2CCCCCC2)C3=CC=CC=C3N4CCCCC4)C(=O)O

InChI

InChI=1S/C31H42N2O4/c1-2-37-29-21-24(16-17-26(29)31(35)36)22-30(34)32-27(20-23-12-6-3-4-7-13-23)25-14-8-9-15-28(25)33-18-10-5-11-19-33/h8-9,14-17,21,23,27H,2-7,10-13,18-20,22H2,1H3,(H,32,34)(H,35,36)