(E)-4-(5-phenethylthiophen-2-yl)but-3-enoic acid

Systemtic Name: (E)-4-(5-phenethylthiophen-2-yl)but-3-enoic acid Openeye Name: (E)-4-(5-phenethyl-2-thienyl)but-3-enoic acid CAS Name: (E)-4-(5-phenethyl-2-thiophenyl)-3-butenoic acid IUPAC Name: (E)-4-(5-phenethylthiophen-2-yl)but-3-enoic acid Traditional Name: (E)-4-(5-phenethyl-2-thienyl)but-3-enoic acid Formula: C16H16O2S MolecularWeight: 272.36204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=C(S2)C=CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=C(S2)/C=C/CC(=O)O

InChI

InChI=1S/C16H16O2S/c17-16(18)8-4-7-14-11-12-15(19-14)10-9-13-5-2-1-3-6-13/h1-7,11-12H,8-10H2,(H,17,18)/b7-4+