N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-6-methyl-1-(2-nitrophenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N-[2-[(3-chlorophenyl)methyl]-3-pyrazolyl]-6-methyl-1-(2-nitrophenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-6-methyl-1-(2-nitrophenyl)-4-oxopyridazine-3-carboxamide Traditional Name: N-[2-(3-chlorobenzyl)pyrazol-3-yl]-4-keto-6-methyl-1-(2-nitrophenyl)pyridazine-3-carboxamide Formula: C22H17ClN6O4 MolecularWeight: 464.86118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3=CC=NN3CC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3=CC=NN3CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H17ClN6O4/c1-14-11-19(30)21(26-28(14)17-7-2-3-8-18(17)29(32)33)22(31)25-20-9-10-24-27(20)13-15-5-4-6-16(23)12-15/h2-12H,13H2,1H3,(H,25,31)