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

Systemtic Name: 3,3-bis(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-nitro-1H-indol-2-one Openeye Name: 3,3-bis(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-5-nitro-indolin-2-one CAS Name: 3,3-bis(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-nitro-1H-indol-2-one IUPAC Name: 3,3-bis(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-nitro-1H-indol-2-one Traditional Name: 3,3-bis(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-5-nitro-oxindole Formula: C30H26N6O5 MolecularWeight: 550.56464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3(C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=C(N(N(C5=O)C6=CC=CC=C6)C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3(C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=C(N(N(C5=O)C6=CC=CC=C6)C)C

InChI

InChI=1S/C30H26N6O5/c1-18-25(27(37)34(32(18)3)20-11-7-5-8-12-20)30(23-17-22(36(40)41)15-16-24(23)31-29(30)39)26-19(2)33(4)35(28(26)38)21-13-9-6-10-14-21/h5-17H,1-4H3,(H,31,39)