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2-[(E)-3-phenylprop-2-enyl]sulfanylbenzene-1,3-dicarboxylic acid

2-[(E)-3-phenylprop-2-enyl]sulfanylbenzene-1,3-dicarboxylic acid

Systemtic Name:2-[(E)-3-phenylprop-2-enyl]sulfanylbenzene-1,3-dicarboxylic acid
Openeye Name:2-[(E)-cinnamyl]sulfanylbenzene-1,3-dicarboxylic acid
CAS Name:2-[[(E)-3-phenylprop-2-enyl]thio]benzene-1,3-dicarboxylic acid
IUPAC Name:2-[(E)-3-phenylprop-2-enyl]sulfanylbenzene-1,3-dicarboxylic acid
Traditional Name:2-[[(E)-cinnamyl]thio]isophthalic acid
Formula: C17H14O4S
MolecularWeight: 314.35566
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=C(C=CC=C2C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=C(C=CC=C2C(=O)O)C(=O)O


InChI

InChI=1S/C17H14O4S/c18-16(19)13-9-4-10-14(17(20)21)15(13)22-11-5-8-12-6-2-1-3-7-12/h1-10H,11H2,(H,18,19)(H,20,21)/b8-5+


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