4-[(E)-2-[4-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]benzoic acid

Systemtic Name: 4-[(E)-2-[4-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]benzoic acid Openeye Name: 4-[(E)-2-[4-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]benzoic acid CAS Name: 4-[(E)-2-[4-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]benzoic acid IUPAC Name: 4-[(E)-2-[4-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]benzoic acid Traditional Name: 4-[(E)-2-[4-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]benzoic acid Formula: C20H18O2S MolecularWeight: 322.42072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=S)CC1=CC=C(C=C1)C=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(=C)C(=S)CC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H18O2S/c1-14(2)19(23)13-17-7-5-15(6-8-17)3-4-16-9-11-18(12-10-16)20(21)22/h3-12H,1,13H2,2H3,(H,21,22)/b4-3+