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

Systemtic Name: 5-bromanyl-3,3-bis(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-methyl-indol-2-one Openeye Name: 5-bromo-3,3-bis(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-methyl-indolin-2-one CAS Name: 5-bromo-3,3-bis(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-methyl-2-indolone IUPAC Name: 5-bromo-3,3-bis(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-methylindol-2-one Traditional Name: 5-bromo-3,3-bis(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-1-methyl-oxindole Formula: C31H28BrN5O3 MolecularWeight: 598.48972

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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)Br)N(C3=O)C)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)Br)N(C3=O)C)C5=C(N(N(C5=O)C6=CC=CC=C6)C)C

InChI

InChI=1S/C31H28BrN5O3/c1-19-26(28(38)36(34(19)4)22-12-8-6-9-13-22)31(24-18-21(32)16-17-25(24)33(3)30(31)40)27-20(2)35(5)37(29(27)39)23-14-10-7-11-15-23/h6-18H,1-5H3