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

Systemtic Name: 2-ethoxy-4-[2-oxidanylidene-2-[1-(2-piperidin-1-ylphenyl)pentylamino]ethyl]benzoic acid Openeye Name: 2-ethoxy-4-[2-oxo-2-[1-[2-(1-piperidyl)phenyl]pentylamino]ethyl]benzoic acid CAS Name: 2-ethoxy-4-[2-oxo-2-[1-[2-(1-piperidinyl)phenyl]pentylamino]ethyl]benzoic acid IUPAC Name: 2-ethoxy-4-[2-oxo-2-[1-(2-piperidin-1-ylphenyl)pentylamino]ethyl]benzoic acid Traditional Name: 2-ethoxy-4-[2-keto-2-[1-(2-piperidinophenyl)pentylamino]ethyl]benzoic acid Formula: C27H36N2O4 MolecularWeight: 452.58574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)O)OCC

Isomeric SMILES

CCCCC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)O)OCC

InChI

InChI=1S/C27H36N2O4/c1-3-5-12-23(21-11-7-8-13-24(21)29-16-9-6-10-17-29)28-26(30)19-20-14-15-22(27(31)32)25(18-20)33-4-2/h7-8,11,13-15,18,23H,3-6,9-10,12,16-17,19H2,1-2H3,(H,28,30)(H,31,32)