[5-[4-(3-methylphenyl)piperidin-1-yl]carbonylpyridin-3-yl]-(pyridin-3-ylmethyl)carbamic acid

Systemtic Name: [5-[4-(3-methylphenyl)piperidin-1-yl]carbonylpyridin-3-yl]-(pyridin-3-ylmethyl)carbamic acid Openeye Name: [5-[4-(m-tolyl)piperidine-1-carbonyl]-3-pyridyl]-(3-pyridylmethyl)carbamic acid CAS Name: [5-[[4-(3-methylphenyl)-1-piperidinyl]-oxomethyl]-3-pyridinyl]-(3-pyridinylmethyl)carbamic acid IUPAC Name: [5-[4-(3-methylphenyl)piperidine-1-carbonyl]pyridin-3-yl]-(pyridin-3-ylmethyl)carbamic acid Traditional Name: [5-[4-(m-tolyl)piperidine-1-carbonyl]-3-pyridyl]-(3-pyridylmethyl)carbamic acid Formula: C25H26N4O3 MolecularWeight: 430.49894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC(=CN=C3)N(CC4=CN=CC=C4)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC(=CN=C3)N(CC4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C25H26N4O3/c1-18-4-2-6-21(12-18)20-7-10-28(11-8-20)24(30)22-13-23(16-27-15-22)29(25(31)32)17-19-5-3-9-26-14-19/h2-6,9,12-16,20H,7-8,10-11,17H2,1H3,(H,31,32)