3-(5-azanyl-1,3-diphenyl-pyrazol-4-yl)-3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-1-ethyl-5-nitro-indol-2-one

Systemtic Name: 3-(5-azanyl-1,3-diphenyl-pyrazol-4-yl)-3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-1-ethyl-5-nitro-indol-2-one Openeye Name: 3-(5-amino-1,3-diphenyl-pyrazol-4-yl)-1-ethyl-3-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-5-nitro-indolin-2-one CAS Name: 3-(5-amino-1,3-diphenyl-4-pyrazolyl)-1-ethyl-3-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-5-nitro-2-indolone IUPAC Name: 3-(5-amino-1,3-diphenylpyrazol-4-yl)-1-ethyl-3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-5-nitroindol-2-one Traditional Name: 3-(5-amino-1,3-diphenyl-pyrazol-4-yl)-1-ethyl-3-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-5-nitro-oxindole Formula: C33H31N5O5 MolecularWeight: 577.62974

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(C1=O)(C3=C(CC(CC3=O)(C)C)O)C4=C(N(N=C4C5=CC=CC=C5)C6=CC=CC=C6)N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(C1=O)(C3=C(CC(CC3=O)(C)C)O)C4=C(N(N=C4C5=CC=CC=C5)C6=CC=CC=C6)N

InChI

InChI=1S/C33H31N5O5/c1-4-36-24-16-15-22(38(42)43)17-23(24)33(31(36)41,27-25(39)18-32(2,3)19-26(27)40)28-29(20-11-7-5-8-12-20)35-37(30(28)34)21-13-9-6-10-14-21/h5-17,39H,4,18-19,34H2,1-3H3