N-(3,4-dimethylphenyl)-1-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-1-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-1-[2-(2-nitroanilino)-2-oxo-ethyl]-6-oxo-pyridazine-3-carboxamide CAS Name: N-(3,4-dimethylphenyl)-1-[2-(2-nitroanilino)-2-oxoethyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-1-[2-(2-nitroanilino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-6-keto-1-[2-keto-2-(2-nitroanilino)ethyl]pyridazine-3-carboxamide Formula: C21H19N5O5 MolecularWeight: 421.40606

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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)NC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C21H19N5O5/c1-13-7-8-15(11-14(13)2)22-21(29)17-9-10-20(28)25(24-17)12-19(27)23-16-5-3-4-6-18(16)26(30)31/h3-11H,12H2,1-2H3,(H,22,29)(H,23,27)