2-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid

Systemtic Name: 2-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid Openeye Name: 2-[1-carbamoyl-2-[2-(1-piperidyl)phenyl]propyl]benzoic acid CAS Name: 2-[1-amino-1-oxo-3-[2-(1-piperidinyl)phenyl]butan-2-yl]benzoic acid IUPAC Name: 2-[1-amino-1-oxo-3-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid Traditional Name: 2-[1-carbamoyl-2-(2-piperidinophenyl)propyl]benzoic acid Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1N2CCCCC2)C(C3=CC=CC=C3C(=O)O)C(=O)N

Isomeric SMILES

CC(C1=CC=CC=C1N2CCCCC2)C(C3=CC=CC=C3C(=O)O)C(=O)N

InChI

InChI=1S/C22H26N2O3/c1-15(16-9-5-6-12-19(16)24-13-7-2-8-14-24)20(21(23)25)17-10-3-4-11-18(17)22(26)27/h3-6,9-12,15,20H,2,7-8,13-14H2,1H3,(H2,23,25)(H,26,27)