4-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperazine-1-carbaldehyde Openeye Name: 4-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperazine-1-carbaldehyde CAS Name: 4-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitrophenyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitrophenyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperazine-1-carbaldehyde Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=NNC(=O)C1C2=CC(=C(C=C2)N3CCN(CC3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1C=NNC(=O)C1C2=CC(=C(C=C2)N3CCN(CC3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O4/c1-11-9-17-18-16(23)15(11)12-2-3-13(14(8-12)21(24)25)20-6-4-19(10-22)5-7-20/h2-3,8-11,15H,4-7H2,1H3,(H,18,23)