3-ethoxy-2-[(E)-2-(2-methylphenyl)ethenyl]-4-sulfanylidene-chromene-6-carboxylic acid

Systemtic Name: 3-ethoxy-2-[(E)-2-(2-methylphenyl)ethenyl]-4-sulfanylidene-chromene-6-carboxylic acid Openeye Name: 3-ethoxy-2-[(E)-2-(o-tolyl)vinyl]-4-thioxo-chromene-6-carboxylic acid CAS Name: 3-ethoxy-2-[(E)-2-(2-methylphenyl)ethenyl]-4-sulfanylidene-1-benzopyran-6-carboxylic acid IUPAC Name: 3-ethoxy-2-[(E)-2-(2-methylphenyl)ethenyl]-4-sulfanylidenechromene-6-carboxylic acid Traditional Name: 3-ethoxy-2-[(E)-2-(o-tolyl)vinyl]-4-thioxo-chromene-6-carboxylic acid Formula: C21H18O4S MolecularWeight: 366.43022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(OC2=C(C1=S)C=C(C=C2)C(=O)O)C=CC3=CC=CC=C3C

Isomeric SMILES

CCOC1=C(OC2=C(C1=S)C=C(C=C2)C(=O)O)/C=C/C3=CC=CC=C3C

InChI

InChI=1S/C21H18O4S/c1-3-24-19-18(11-8-14-7-5-4-6-13(14)2)25-17-10-9-15(21(22)23)12-16(17)20(19)26/h4-12H,3H2,1-2H3,(H,22,23)/b11-8+