methyl 6-chloranyl-3-cyano-2-[[6-methyl-2-(propylcarbamoyl)pyridin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 6-chloranyl-3-cyano-2-[[6-methyl-2-(propylcarbamoyl)pyridin-3-yl]carbonylamino]benzoate Openeye Name: methyl 6-chloro-3-cyano-2-[[6-methyl-2-(propylcarbamoyl)pyridine-3-carbonyl]amino]benzoate CAS Name: 6-chloro-3-cyano-2-[[[6-methyl-2-[oxo(propylamino)methyl]-3-pyridinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 6-chloro-3-cyano-2-[[6-methyl-2-(propylcarbamoyl)pyridine-3-carbonyl]amino]benzoate Traditional Name: 6-chloro-3-cyano-2-[[6-methyl-2-(propylcarbamoyl)nicotinoyl]amino]benzoic acid methyl ester Formula: C20H19ClN4O4 MolecularWeight: 414.84226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C=CC(=N1)C)C(=O)NC2=C(C=CC(=C2C(=O)OC)Cl)C#N

Isomeric SMILES

CCCNC(=O)C1=C(C=CC(=N1)C)C(=O)NC2=C(C=CC(=C2C(=O)OC)Cl)C#N

InChI

InChI=1S/C20H19ClN4O4/c1-4-9-23-19(27)17-13(7-5-11(2)24-17)18(26)25-16-12(10-22)6-8-14(21)15(16)20(28)29-3/h5-8H,4,9H2,1-3H3,(H,23,27)(H,25,26)