4-[[6-(1-methylpiperidin-4-yl)carbonylpyridin-2-yl]carbamoyl]benzoic acid

Systemtic Name: 4-[[6-(1-methylpiperidin-4-yl)carbonylpyridin-2-yl]carbamoyl]benzoic acid Openeye Name: 4-[[6-(1-methylpiperidine-4-carbonyl)-2-pyridyl]carbamoyl]benzoic acid CAS Name: 4-[[[6-[(1-methyl-4-piperidinyl)-oxomethyl]-2-pyridinyl]amino]-oxomethyl]benzoic acid IUPAC Name: 4-[[6-(1-methylpiperidine-4-carbonyl)pyridin-2-yl]carbamoyl]benzoic acid Traditional Name: 4-[[6-(1-methylisonipecotoyl)-2-pyridyl]carbamoyl]benzoic acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C(=O)C2=NC(=CC=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1CCC(CC1)C(=O)C2=NC(=CC=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H21N3O4/c1-23-11-9-13(10-12-23)18(24)16-3-2-4-17(21-16)22-19(25)14-5-7-15(8-6-14)20(26)27/h2-8,13H,9-12H2,1H3,(H,26,27)(H,21,22,25)