(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-bromanylbenzoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-bromanylbenzoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 3-bromobenzoate CAS Name: 3-bromobenzoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 3-bromobenzoate Traditional Name: 3-bromobenzoic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C18H12BrClO4 MolecularWeight: 407.64248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC=C3)Br)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC(=CC=C3)Br)Cl

InChI

InChI=1S/C18H12BrClO4/c1-10-5-16-14(8-15(10)20)12(7-17(21)24-16)9-23-18(22)11-3-2-4-13(19)6-11/h2-8H,9H2,1H3