4-[2-[(1-cyclohexyl-2-oxidanylidene-pyridin-3-yl)carbonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(1-cyclohexyl-2-oxidanylidene-pyridin-3-yl)carbonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(1-cyclohexyl-2-oxo-pyridine-3-carbonyl)amino]ethyl]benzoic acid CAS Name: 4-[2-[[(1-cyclohexyl-2-oxo-3-pyridinyl)-oxomethyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[(1-cyclohexyl-2-oxopyridine-3-carbonyl)amino]ethyl]benzoic acid Traditional Name: 4-[2-[(1-cyclohexyl-2-keto-nicotinoyl)amino]ethyl]benzoic acid Formula: C21H24N2O4 MolecularWeight: 368.42626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C=CC=C(C2=O)C(=O)NCCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)N2C=CC=C(C2=O)C(=O)NCCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H24N2O4/c24-19(22-13-12-15-8-10-16(11-9-15)21(26)27)18-7-4-14-23(20(18)25)17-5-2-1-3-6-17/h4,7-11,14,17H,1-3,5-6,12-13H2,(H,22,24)(H,26,27)