(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-bromanylbenzoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-bromanylbenzoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C18H13BrO5 MolecularWeight: 389.19682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=CC=C3Br)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=CC=C3Br)O

InChI

InChI=1S/C18H13BrO5/c1-10-15(20)7-6-12-11(8-16(21)24-17(10)12)9-23-18(22)13-4-2-3-5-14(13)19/h2-8,20H,9H2,1H3