2-[[3,3-bis(3,5-dimethyl-4-oxidanyl-phenyl)-5-methyl-2-oxidanylidene-indol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[3,3-bis(3,5-dimethyl-4-oxidanyl-phenyl)-5-methyl-2-oxidanylidene-indol-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[3,3-bis(4-hydroxy-3,5-dimethyl-phenyl)-5-methyl-2-oxo-indolin-1-yl]methyl]benzonitrile CAS Name: 2-[[3,3-bis(4-hydroxy-3,5-dimethylphenyl)-5-methyl-2-oxo-1-indolyl]methyl]benzonitrile IUPAC Name: 2-[[3,3-bis(4-hydroxy-3,5-dimethylphenyl)-5-methyl-2-oxoindol-1-yl]methyl]benzonitrile Traditional Name: 2-[[3,3-bis(4-hydroxy-3,5-dimethyl-phenyl)-2-keto-5-methyl-indolin-1-yl]methyl]benzonitrile Formula: C33H30N2O3 MolecularWeight: 502.6029

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2(C3=CC(=C(C(=C3)C)O)C)C4=CC(=C(C(=C4)C)O)C)CC5=CC=CC=C5C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2(C3=CC(=C(C(=C3)C)O)C)C4=CC(=C(C(=C4)C)O)C)CC5=CC=CC=C5C#N

InChI

InChI=1S/C33H30N2O3/c1-19-10-11-29-28(12-19)33(26-13-20(2)30(36)21(3)14-26,27-15-22(4)31(37)23(5)16-27)32(38)35(29)18-25-9-7-6-8-24(25)17-34/h6-16,36-37H,18H2,1-5H3