3-[5-azanyl-1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]-3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-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)-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)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)-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)-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)oxindole Formula: C31H27N5O5 MolecularWeight: 549.57658

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C2(C3=CC=CC=C3NC2=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=CC=CC=C3NC2=O)C4=C(N(N=C4C5=CC=CC=C5)C6=CC=C(C=C6)[N+](=O)[O-])N)O)C

InChI

InChI=1S/C31H27N5O5/c1-30(2)16-23(37)25(24(38)17-30)31(21-10-6-7-11-22(21)33-29(31)39)26-27(18-8-4-3-5-9-18)34-35(28(26)32)19-12-14-20(15-13-19)36(40)41/h3-15,37H,16-17,32H2,1-2H3,(H,33,39)