4-[2-(bromomethyl)-4-methoxy-6-methyl-phenyl]-3-(4-methoxyphenyl)carbonyl-benzenecarbonitrile

Systemtic Name: 4-[2-(bromomethyl)-4-methoxy-6-methyl-phenyl]-3-(4-methoxyphenyl)carbonyl-benzenecarbonitrile Openeye Name: 4-[2-(bromomethyl)-4-methoxy-6-methyl-phenyl]-3-(4-methoxybenzoyl)benzonitrile CAS Name: 4-[2-(bromomethyl)-4-methoxy-6-methylphenyl]-3-[(4-methoxyphenyl)-oxomethyl]benzonitrile IUPAC Name: 4-[2-(bromomethyl)-4-methoxy-6-methylphenyl]-3-(4-methoxybenzoyl)benzonitrile Traditional Name: 4-[2-(bromomethyl)-4-methoxy-6-methyl-phenyl]-3-p-anisoyl-benzonitrile Formula: C24H20BrNO3 MolecularWeight: 450.3245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C2=C(C=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)OC)CBr)OC

Isomeric SMILES

CC1=CC(=CC(=C1C2=C(C=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)OC)CBr)OC

InChI

InChI=1S/C24H20BrNO3/c1-15-10-20(29-3)12-18(13-25)23(15)21-9-4-16(14-26)11-22(21)24(27)17-5-7-19(28-2)8-6-17/h4-12H,13H2,1-3H3