4-[(Z)-2-oxidanylidenehept-3-en-3-yl]sulfanylbenzoic acid

Systemtic Name: 4-[(Z)-2-oxidanylidenehept-3-en-3-yl]sulfanylbenzoic acid Openeye Name: 4-[(Z)-1-acetylpent-1-enyl]sulfanylbenzoic acid CAS Name: 4-[[(Z)-2-oxohept-3-en-3-yl]thio]benzoic acid IUPAC Name: 4-[(Z)-2-oxohept-3-en-3-yl]sulfanylbenzoic acid Traditional Name: 4-[[(Z)-1-acetylpent-1-enyl]thio]benzoic acid Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=C(C(=O)C)SC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCC/C=C(/C(=O)C)\SC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C14H16O3S/c1-3-4-5-13(10(2)15)18-12-8-6-11(7-9-12)14(16)17/h5-9H,3-4H2,1-2H3,(H,16,17)/b13-5-