(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 4-methylbenzoate

Systemtic Name: (6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 4-methylbenzoate Openeye Name: (6-chloro-4-methyl-2-oxo-chromen-7-yl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid (6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-4-methyl-2-oxochromen-7-yl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (6-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C18H13ClO4 MolecularWeight: 328.74642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13ClO4/c1-10-3-5-12(6-4-10)18(21)23-16-9-15-13(8-14(16)19)11(2)7-17(20)22-15/h3-9H,1-2H3