methyl 4-[[2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)NCC2=CC=C(C=C2)C(=O)OC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)NCC2=CC=C(C=C2)C(=O)OC)C#N

InChI

InChI=1S/C18H18N4O4/c1-11-12(2)21-22(17(24)15(11)8-19)10-16(23)20-9-13-4-6-14(7-5-13)18(25)26-3/h4-7H,9-10H2,1-3H3,(H,20,23)