[6-chloranyl-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-chromen-7-yl] 4-methylbenzoate

Systemtic Name: [6-chloranyl-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-chromen-7-yl] 4-methylbenzoate Openeye Name: [6-chloro-3-(2-methoxy-2-oxo-ethyl)-4-methyl-2-oxo-chromen-7-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxochromen-7-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [6-chloro-2-keto-3-(2-keto-2-methoxy-ethyl)-4-methyl-chromen-7-yl] ester Formula: C21H17ClO6 MolecularWeight: 400.80908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C3C(=C(C(=O)OC3=C2)CC(=O)OC)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C3C(=C(C(=O)OC3=C2)CC(=O)OC)C)Cl

InChI

InChI=1S/C21H17ClO6/c1-11-4-6-13(7-5-11)20(24)28-18-10-17-14(8-16(18)22)12(2)15(21(25)27-17)9-19(23)26-3/h4-8,10H,9H2,1-3H3