methyl 4-[[5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]methylcarbamoylamino]benzoate

Systemtic Name: methyl 4-[[5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]methylcarbamoylamino]benzoate Openeye Name: methyl 4-[(5-cyano-4-methyl-2,6-dioxo-3-pyridylidene)methylcarbamoylamino]benzoate CAS Name: 4-[[[(5-cyano-4-methyl-2,6-dioxo-3-pyridinylidene)methylamino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-cyano-4-methyl-2,6-dioxopyridin-3-ylidene)methylcarbamoylamino]benzoate Traditional Name: 4-[(5-cyano-2,6-diketo-4-methyl-3-pyridylidene)methylcarbamoylamino]benzoic acid methyl ester Formula: C17H14N4O5 MolecularWeight: 354.31686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)C1=CNC(=O)NC2=CC=C(C=C2)C(=O)OC)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=O)C1=CNC(=O)NC2=CC=C(C=C2)C(=O)OC)C#N

InChI

InChI=1S/C17H14N4O5/c1-9-12(7-18)14(22)21-15(23)13(9)8-19-17(25)20-11-5-3-10(4-6-11)16(24)26-2/h3-6,8H,1-2H3,(H2,19,20,25)(H,21,22,23)