2-[(E)-2-[3-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]benzoate

Systemtic Name: 2-[(E)-2-[3-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]benzoate Openeye Name: 2-[(E)-2-[3-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]benzoate CAS Name: 2-[(E)-2-[3-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]benzoate IUPAC Name: 2-[(E)-2-[3-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]benzoate Traditional Name: 2-[(E)-2-[3-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]benzoate Formula: C20H17O2S- MolecularWeight: 321.41278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=S)CC1=CC=CC(=C1)C=CC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC(=C)C(=S)CC1=CC=CC(=C1)/C=C/C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C20H18O2S/c1-14(2)19(23)13-16-7-5-6-15(12-16)10-11-17-8-3-4-9-18(17)20(21)22/h3-12H,1,13H2,2H3,(H,21,22)/p-1/b11-10+