5-(2-methylpropyl)-4-(3-nitrophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: 5-(2-methylpropyl)-4-(3-nitrophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: 5-isobutyl-4-(3-nitrophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one CAS Name: 5-(2-methylpropyl)-4-(3-nitrophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 5-(2-methylpropyl)-4-(3-nitrophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: 5-isobutyl-4-(3-nitrophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(C2=C(C1=O)NN=C2C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C(C2=C(C1=O)NN=C2C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O3/c1-13(2)12-24-20(15-9-6-10-16(11-15)25(27)28)17-18(14-7-4-3-5-8-14)22-23-19(17)21(24)26/h3-11,13,20H,12H2,1-2H3,(H,22,23)