S-(4-methylphenyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enethioate

Systemtic Name: S-(4-methylphenyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enethioate Openeye Name: S-(p-tolyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enethioate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enethioate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)prop-2-enethioic acid S-(p-tolyl) ester Formula: C17H14O3S MolecularWeight: 298.35626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H14O3S/c1-12-2-6-14(7-3-12)21-17(18)9-5-13-4-8-15-16(10-13)20-11-19-15/h2-10H,11H2,1H3/b9-5+