4-[(E)-3-(4-bromophenyl)prop-2-enoyl]-5-methoxy-1,3-benzoxathiol-2-one

Systemtic Name: 4-[(E)-3-(4-bromophenyl)prop-2-enoyl]-5-methoxy-1,3-benzoxathiol-2-one Openeye Name: 4-[(E)-3-(4-bromophenyl)prop-2-enoyl]-5-methoxy-1,3-benzoxathiol-2-one CAS Name: 4-[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]-5-methoxy-1,3-benzoxathiol-2-one IUPAC Name: 4-[(E)-3-(4-bromophenyl)prop-2-enoyl]-5-methoxy-1,3-benzoxathiol-2-one Traditional Name: 4-[(E)-3-(4-bromophenyl)acryloyl]-5-methoxy-1,3-benzoxathiol-2-one Formula: C17H11BrO4S MolecularWeight: 391.23584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)OC(=O)S2)C(=O)C=CC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C2=C(C=C1)OC(=O)S2)C(=O)/C=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H11BrO4S/c1-21-13-8-9-14-16(23-17(20)22-14)15(13)12(19)7-4-10-2-5-11(18)6-3-10/h2-9H,1H3/b7-4+