3,3-bis(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-7-methyl-5-nitro-1H-indol-2-one

Systemtic Name: 3,3-bis(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-7-methyl-5-nitro-1H-indol-2-one Openeye Name: 3,3-bis(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-7-methyl-5-nitro-indolin-2-one CAS Name: 3,3-bis(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-7-methyl-5-nitro-1H-indol-2-one IUPAC Name: 3,3-bis(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-7-methyl-5-nitro-1H-indol-2-one Traditional Name: 3,3-bis(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-7-methyl-5-nitro-oxindole Formula: C31H28N6O5 MolecularWeight: 564.59122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(C(=O)N2)(C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=C(N(N(C5=O)C6=CC=CC=C6)C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(C(=O)N2)(C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=C(N(N(C5=O)C6=CC=CC=C6)C)C

InChI

InChI=1S/C31H28N6O5/c1-18-16-23(37(41)42)17-24-27(18)32-30(40)31(24,25-19(2)33(4)35(28(25)38)21-12-8-6-9-13-21)26-20(3)34(5)36(29(26)39)22-14-10-7-11-15-22/h6-17H,1-5H3,(H,32,40)