[1-[[2,5-bis(chloranyl)phenyl]amino]-1-oxidanylidene-butan-2-yl] pyridine-3-carboxylate

Systemtic Name: [1-[[2,5-bis(chloranyl)phenyl]amino]-1-oxidanylidene-butan-2-yl] pyridine-3-carboxylate Openeye Name: 1-[(2,5-dichlorophenyl)carbamoyl]propyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [1-(2,5-dichloroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,5-dichloroanilino)-1-oxobutan-2-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid 1-[(2,5-dichlorophenyl)carbamoyl]propyl ester Formula: C16H14Cl2N2O3 MolecularWeight: 353.19996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14Cl2N2O3/c1-2-14(23-16(22)10-4-3-7-19-9-10)15(21)20-13-8-11(17)5-6-12(13)18/h3-9,14H,2H2,1H3,(H,20,21)