(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-bromophenyl)sulfanylethanoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C19H15BrO4S MolecularWeight: 419.289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H15BrO4S/c1-12-2-7-16-13(9-18(21)24-17(16)8-12)10-23-19(22)11-25-15-5-3-14(20)4-6-15/h2-9H,10-11H2,1H3