4-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-3-nitro-benzamide

Systemtic Name: 4-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-3-nitro-benzamide Openeye Name: 4-[(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl]-3-nitro-benzamide CAS Name: 4-[(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl]-3-nitrobenzamide IUPAC Name: 4-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl]-3-nitrobenzamide Traditional Name: 4-[(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl]-3-nitro-benzamide Formula: C15H13N5O4 MolecularWeight: 327.29482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H13N5O4/c1-8-9(2)18-19(15(22)12(8)6-16)7-11-4-3-10(14(17)21)5-13(11)20(23)24/h3-5H,7H2,1-2H3,(H2,17,21)