4-[2-oxidanylidene-2-[1-(3-piperidin-1-ylphenyl)ethylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-oxidanylidene-2-[1-(3-piperidin-1-ylphenyl)ethylamino]ethyl]benzoic acid Openeye Name: 4-[2-oxo-2-[1-[3-(1-piperidyl)phenyl]ethylamino]ethyl]benzoic acid CAS Name: 4-[2-oxo-2-[1-[3-(1-piperidinyl)phenyl]ethylamino]ethyl]benzoic acid IUPAC Name: 4-[2-oxo-2-[1-(3-piperidin-1-ylphenyl)ethylamino]ethyl]benzoic acid Traditional Name: 4-[2-keto-2-[1-(3-piperidinophenyl)ethylamino]ethyl]benzoic acid Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)N2CCCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C1=CC(=CC=C1)N2CCCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H26N2O3/c1-16(19-6-5-7-20(15-19)24-12-3-2-4-13-24)23-21(25)14-17-8-10-18(11-9-17)22(26)27/h5-11,15-16H,2-4,12-14H2,1H3,(H,23,25)(H,26,27)