5-[(E)-2-(1-benzothiophen-2-yl)ethenyl]-2,2-dimethyl-furan-3-one

Systemtic Name: 5-[(E)-2-(1-benzothiophen-2-yl)ethenyl]-2,2-dimethyl-furan-3-one Openeye Name: 5-[(E)-2-(benzothiophen-2-yl)vinyl]-2,2-dimethyl-furan-3-one CAS Name: 5-[(E)-2-(1-benzothiophen-2-yl)ethenyl]-2,2-dimethyl-3-furanone IUPAC Name: 5-[(E)-2-(1-benzothiophen-2-yl)ethenyl]-2,2-dimethylfuran-3-one Traditional Name: 5-[(E)-2-(benzothiophen-2-yl)vinyl]-2,2-dimethyl-furan-3-one Formula: C16H14O2S MolecularWeight: 270.34616

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C(O1)C=CC2=CC3=CC=CC=C3S2)C

Isomeric SMILES

CC1(C(=O)C=C(O1)/C=C/C2=CC3=CC=CC=C3S2)C

InChI

InChI=1S/C16H14O2S/c1-16(2)15(17)10-12(18-16)7-8-13-9-11-5-3-4-6-14(11)19-13/h3-10H,1-2H3/b8-7+