3-[5-azanyl-1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]-3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-5-nitro-1H-indol-2-one

Systemtic Name: 3-[5-azanyl-1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]-3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-5-nitro-1H-indol-2-one Openeye Name: 3-[5-amino-1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]-3-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-5-nitro-indolin-2-one CAS Name: 3-[5-amino-1-(4-nitrophenyl)-3-phenyl-4-pyrazolyl]-3-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-5-nitro-1H-indol-2-one IUPAC Name: 3-[5-amino-1-(4-nitrophenyl)-3-phenylpyrazol-4-yl]-3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-5-nitro-1H-indol-2-one Traditional Name: 3-[5-amino-1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]-3-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-5-nitro-oxindole Formula: C31H26N6O7 MolecularWeight: 594.57414

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C2(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=C(N(N=C4C5=CC=CC=C5)C6=CC=C(C=C6)[N+](=O)[O-])N)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C2(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=C(N(N=C4C5=CC=CC=C5)C6=CC=C(C=C6)[N+](=O)[O-])N)O)C

InChI

InChI=1S/C31H26N6O7/c1-30(2)15-23(38)25(24(39)16-30)31(21-14-20(37(43)44)12-13-22(21)33-29(31)40)26-27(17-6-4-3-5-7-17)34-35(28(26)32)18-8-10-19(11-9-18)36(41)42/h3-14,38H,15-16,32H2,1-2H3,(H,33,40)