4-[[2,4-bis[(4-methylphenyl)carbonyl]-5-oxidanyl-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2,4-bis[(4-methylphenyl)carbonyl]-5-oxidanyl-phenoxy]methyl]benzenecarbonitrile Openeye Name: 4-[[5-hydroxy-2,4-bis(4-methylbenzoyl)phenoxy]methyl]benzonitrile CAS Name: 4-[[5-hydroxy-2,4-bis[(4-methylphenyl)-oxomethyl]phenoxy]methyl]benzonitrile IUPAC Name: 4-[[5-hydroxy-2,4-bis(4-methylbenzoyl)phenoxy]methyl]benzonitrile Traditional Name: 4-[[5-hydroxy-2,4-bis(p-toluoyl)phenoxy]methyl]benzonitrile Formula: C30H23NO4 MolecularWeight: 461.50792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2O)OCC3=CC=C(C=C3)C#N)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2O)OCC3=CC=C(C=C3)C#N)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C30H23NO4/c1-19-3-11-23(12-4-19)29(33)25-15-26(30(34)24-13-5-20(2)6-14-24)28(16-27(25)32)35-18-22-9-7-21(17-31)8-10-22/h3-16,32H,18H2,1-2H3