[6,8-dimethyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-tert-butylbenzoate

Systemtic Name: [6,8-dimethyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-tert-butylbenzoate Openeye Name: [6,8-dimethyl-4-oxo-2-(p-tolyl)chromen-3-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [6,8-dimethyl-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6,8-dimethyl-2-(4-methylphenyl)-4-oxochromen-3-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [4-keto-6,8-dimethyl-2-(p-tolyl)chromen-3-yl] ester Formula: C29H28O4 MolecularWeight: 440.53022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC(=CC(=C3O2)C)C)OC(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC(=CC(=C3O2)C)C)OC(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C29H28O4/c1-17-7-9-20(10-8-17)26-27(24(30)23-16-18(2)15-19(3)25(23)32-26)33-28(31)21-11-13-22(14-12-21)29(4,5)6/h7-16H,1-6H3