methyl 2-[3-[(3,4-dimethylphenyl)carbamoyl]-6-oxidanylidene-pyridazin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[(3,4-dimethylphenyl)carbamoyl]-6-oxidanylidene-pyridazin-1-yl]ethanoate Openeye Name: methyl 2-[3-[(3,4-dimethylphenyl)carbamoyl]-6-oxo-pyridazin-1-yl]acetate CAS Name: 2-[3-[(3,4-dimethylanilino)-oxomethyl]-6-oxo-1-pyridazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(3,4-dimethylphenyl)carbamoyl]-6-oxopyridazin-1-yl]acetate Traditional Name: 2-[3-[(3,4-dimethylphenyl)carbamoyl]-6-keto-pyridazin-1-yl]acetic acid methyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)OC)C

InChI

InChI=1S/C16H17N3O4/c1-10-4-5-12(8-11(10)2)17-16(22)13-6-7-14(20)19(18-13)9-15(21)23-3/h4-8H,9H2,1-3H3,(H,17,22)