1,5-dimethyl-4-[(E)-3-(4-nitrophenyl)-3-oxidanylidene-prop-1-enyl]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[(E)-3-(4-nitrophenyl)-3-oxidanylidene-prop-1-enyl]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[(E)-3-(4-nitrophenyl)-3-oxo-prop-1-enyl]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[(E)-3-(4-nitrophenyl)-3-oxoprop-1-enyl]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[(E)-3-(4-nitrophenyl)-3-oxoprop-1-enyl]-2-phenylpyrazol-3-one Traditional Name: 4-[(E)-3-keto-3-(4-nitrophenyl)prop-1-enyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C=CC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)/C=C/C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O4/c1-14-18(20(25)22(21(14)2)16-6-4-3-5-7-16)12-13-19(24)15-8-10-17(11-9-15)23(26)27/h3-13H,1-2H3/b13-12+