ethyl (E)-2-cyano-3-[4-[(1-methyl-6-oxidanylidene-pyridazin-3-yl)carbonylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[4-[(1-methyl-6-oxidanylidene-pyridazin-3-yl)carbonylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-[(1-methyl-6-oxo-pyridazine-3-carbonyl)amino]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-[[(1-methyl-6-oxo-3-pyridazinyl)-oxomethyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-[(1-methyl-6-oxopyridazine-3-carbonyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-[(6-keto-1-methyl-pyridazine-3-carbonyl)amino]phenyl]acrylic acid ethyl ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)C)/C#N

InChI

InChI=1S/C18H16N4O4/c1-3-26-18(25)13(11-19)10-12-4-6-14(7-5-12)20-17(24)15-8-9-16(23)22(2)21-15/h4-10H,3H2,1-2H3,(H,20,24)/b13-10+