(9E)-9-[(3-methoxy-4-oxidanyl-phenyl)methylidene]benzo[f][1]benzothiol-4-one

Systemtic Name: (9E)-9-[(3-methoxy-4-oxidanyl-phenyl)methylidene]benzo[f][1]benzothiol-4-one Openeye Name: (9E)-9-[(4-hydroxy-3-methoxy-phenyl)methylene]benzo[f]benzothiophen-4-one CAS Name: (9E)-9-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-benzo[f][1]benzothiolone IUPAC Name: (9E)-9-[(4-hydroxy-3-methoxyphenyl)methylidene]benzo[f][1]benzothiol-4-one Traditional Name: (9E)-9-vanillylidenebenzo[f]benzothiophen-4-one Formula: C20H14O3S MolecularWeight: 334.38836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C3=CC=CC=C3C(=O)C4=C2SC=C4)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C3=CC=CC=C3C(=O)C4=C2SC=C4)O

InChI

InChI=1S/C20H14O3S/c1-23-18-11-12(6-7-17(18)21)10-16-13-4-2-3-5-14(13)19(22)15-8-9-24-20(15)16/h2-11,21H,1H3/b16-10+