[1-[(4-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [1-[(4-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 2-chloranylpyridine-4-carboxylate Openeye Name: 1-[(4-methyl-2-pyridyl)carbamoyl]propyl 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [1-[(4-methyl-2-pyridinyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(4-methylpyridin-2-yl)amino]-1-oxobutan-2-yl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid 1-[(4-methyl-2-pyridyl)carbamoyl]propyl ester Formula: C16H16ClN3O3 MolecularWeight: 333.76954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC=CC(=C1)C)OC(=O)C2=CC(=NC=C2)Cl

Isomeric SMILES

CCC(C(=O)NC1=NC=CC(=C1)C)OC(=O)C2=CC(=NC=C2)Cl

InChI

InChI=1S/C16H16ClN3O3/c1-3-12(15(21)20-14-8-10(2)4-6-19-14)23-16(22)11-5-7-18-13(17)9-11/h4-9,12H,3H2,1-2H3,(H,19,20,21)