2-(2-chloranyl-5-nitro-phenyl)-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one

Systemtic Name: 2-(2-chloranyl-5-nitro-phenyl)-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one Openeye Name: 2-(2-chloro-5-nitro-phenyl)-5-methyl-4-(p-tolylmethylene)pyrazol-3-one CAS Name: 2-(2-chloro-5-nitrophenyl)-5-methyl-4-[(4-methylphenyl)methylidene]-3-pyrazolone IUPAC Name: 2-(2-chloro-5-nitrophenyl)-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one Traditional Name: 2-(2-chloro-5-nitro-phenyl)-5-methyl-4-(4-methylbenzylidene)-2-pyrazolin-3-one Formula: C18H14ClN3O3 MolecularWeight: 355.77506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C18H14ClN3O3/c1-11-3-5-13(6-4-11)9-15-12(2)20-21(18(15)23)17-10-14(22(24)25)7-8-16(17)19/h3-10H,1-2H3