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

Systemtic Name: [2-(4-chlorophenyl)-4-oxidanylidene-chromen-3-yl] 4-tert-butylbenzoate Openeye Name: [2-(4-chlorophenyl)-4-oxo-chromen-3-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-(4-chlorophenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-chlorophenyl)-4-oxochromen-3-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [2-(4-chlorophenyl)-4-keto-chromen-3-yl] ester Formula: C26H21ClO4 MolecularWeight: 432.89554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H21ClO4/c1-26(2,3)18-12-8-17(9-13-18)25(29)31-24-22(28)20-6-4-5-7-21(20)30-23(24)16-10-14-19(27)15-11-16/h4-15H,1-3H3