[2-(2-chlorophenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 4-tert-butylbenzoate

Systemtic Name: [2-(2-chlorophenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 4-tert-butylbenzoate Openeye Name: [2-(2-chlorophenyl)-6-methyl-4-oxo-chromen-3-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-(2-chlorophenyl)-6-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(2-chlorophenyl)-6-methyl-4-oxochromen-3-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [2-(2-chlorophenyl)-4-keto-6-methyl-chromen-3-yl] ester Formula: C27H23ClO4 MolecularWeight: 446.92212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4Cl

InChI

InChI=1S/C27H23ClO4/c1-16-9-14-22-20(15-16)23(29)25(24(31-22)19-7-5-6-8-21(19)28)32-26(30)17-10-12-18(13-11-17)27(2,3)4/h5-15H,1-4H3