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

Systemtic Name: 4-[(cyclopropylamino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one Openeye Name: 4-[(cyclopropylamino)methylene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one CAS Name: 4-[(cyclopropylamino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: 4-[(cyclopropylamino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: 4-[(cyclopropylamino)methylene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNC3CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNC3CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4/c1-28-17-10-2-13(3-11-17)19-18(12-21-14-4-5-14)20(25)23(22-19)15-6-8-16(9-7-15)24(26)27/h2-3,6-12,14,21H,4-5H2,1H3