methyl 4-[(4-oxidanyl-4-pyridin-3-yl-piperidin-1-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(4-oxidanyl-4-pyridin-3-yl-piperidin-1-yl)carbonylamino]benzoate Openeye Name: methyl 4-[[4-hydroxy-4-(3-pyridyl)piperidine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-hydroxy-4-(3-pyridinyl)-1-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-hydroxy-4-pyridin-3-ylpiperidine-1-carbonyl)amino]benzoate Traditional Name: 4-[[4-hydroxy-4-(3-pyridyl)piperidine-1-carbonyl]amino]benzoic acid methyl ester Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCC(CC2)(C3=CN=CC=C3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCC(CC2)(C3=CN=CC=C3)O

InChI

InChI=1S/C19H21N3O4/c1-26-17(23)14-4-6-16(7-5-14)21-18(24)22-11-8-19(25,9-12-22)15-3-2-10-20-13-15/h2-7,10,13,25H,8-9,11-12H2,1H3,(H,21,24)