[1-[(5-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 2-chloranylpyridine-3-carboxylate

Systemtic Name: [1-[(5-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 2-chloranylpyridine-3-carboxylate Openeye Name: 1-[(5-methyl-2-pyridyl)carbamoyl]propyl 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [1-[(5-methyl-2-pyridinyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(5-methylpyridin-2-yl)amino]-1-oxobutan-2-yl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid 1-[(5-methyl-2-pyridyl)carbamoyl]propyl ester Formula: C16H16ClN3O3 MolecularWeight: 333.76954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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