2-(4-methoxyphenyl)-5-methyl-4-[(4-nitrophenyl)methylidene]pyrazol-3-one

Systemtic Name: 2-(4-methoxyphenyl)-5-methyl-4-[(4-nitrophenyl)methylidene]pyrazol-3-one Openeye Name: 2-(4-methoxyphenyl)-5-methyl-4-[(4-nitrophenyl)methylene]pyrazol-3-one CAS Name: 2-(4-methoxyphenyl)-5-methyl-4-[(4-nitrophenyl)methylidene]-3-pyrazolone IUPAC Name: 2-(4-methoxyphenyl)-5-methyl-4-[(4-nitrophenyl)methylidene]pyrazol-3-one Traditional Name: 2-(4-methoxyphenyl)-5-methyl-4-(4-nitrobenzylidene)-2-pyrazolin-3-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H15N3O4/c1-12-17(11-13-3-5-15(6-4-13)21(23)24)18(22)20(19-12)14-7-9-16(25-2)10-8-14/h3-11H,1-2H3