[5-[4-(3-methylphenyl)piperidin-1-yl]carbonylpyridin-3-yl]-(pyridin-2-ylmethyl)carbamic acid

Systemtic Name: [5-[4-(3-methylphenyl)piperidin-1-yl]carbonylpyridin-3-yl]-(pyridin-2-ylmethyl)carbamic acid Openeye Name: [5-[4-(m-tolyl)piperidine-1-carbonyl]-3-pyridyl]-(2-pyridylmethyl)carbamic acid CAS Name: [5-[[4-(3-methylphenyl)-1-piperidinyl]-oxomethyl]-3-pyridinyl]-(2-pyridinylmethyl)carbamic acid IUPAC Name: [5-[4-(3-methylphenyl)piperidine-1-carbonyl]pyridin-3-yl]-(pyridin-2-ylmethyl)carbamic acid Traditional Name: [5-[4-(m-tolyl)piperidine-1-carbonyl]-3-pyridyl]-(2-pyridylmethyl)carbamic acid Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC(=CN=C3)N(CC4=CC=CC=N4)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC(=CN=C3)N(CC4=CC=CC=N4)C(=O)O

InChI

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