[2-(4-chlorophenyl)-6-ethyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate

Systemtic Name: [2-(4-chlorophenyl)-6-ethyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate Openeye Name: [2-(4-chlorophenyl)-6-ethyl-4-oxo-chromen-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-(4-chlorophenyl)-6-ethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-chlorophenyl)-6-ethyl-4-oxochromen-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-(4-chlorophenyl)-6-ethyl-4-keto-chromen-3-yl] ester Formula: C25H19ClO4 MolecularWeight: 418.86896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H19ClO4/c1-3-16-6-13-21-20(14-16)22(27)24(23(29-21)17-9-11-19(26)12-10-17)30-25(28)18-7-4-15(2)5-8-18/h4-14H,3H2,1-2H3