5-methyl-4-[(E)-[5-(4-nitrophenyl)pyrrol-2-ylidene]methyl]-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-methyl-4-[(E)-[5-(4-nitrophenyl)pyrrol-2-ylidene]methyl]-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-methyl-4-[(E)-[5-(4-nitrophenyl)pyrrol-2-ylidene]methyl]-2-phenyl-1H-pyrazol-3-one CAS Name: 5-methyl-4-[(E)-[5-(4-nitrophenyl)-2-pyrrolylidene]methyl]-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-methyl-4-[(E)-[5-(4-nitrophenyl)pyrrol-2-ylidene]methyl]-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-methyl-4-[(E)-[5-(4-nitrophenyl)pyrrol-2-ylidene]methyl]-2-phenyl-3-pyrazolin-3-one Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C=CC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)/C=C/3\C=CC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O3/c1-14-19(21(26)24(23-14)17-5-3-2-4-6-17)13-16-9-12-20(22-16)15-7-10-18(11-8-15)25(27)28/h2-13,23H,1H3/b16-13+