(E)-4-[5-(6-phenylhexyl)thiophen-2-yl]but-3-enoic acid

Systemtic Name: (E)-4-[5-(6-phenylhexyl)thiophen-2-yl]but-3-enoic acid Openeye Name: (E)-4-[5-(6-phenylhexyl)-2-thienyl]but-3-enoic acid CAS Name: (E)-4-[5-(6-phenylhexyl)-2-thiophenyl]-3-butenoic acid IUPAC Name: (E)-4-[5-(6-phenylhexyl)thiophen-2-yl]but-3-enoic acid Traditional Name: (E)-4-[5-(6-phenylhexyl)-2-thienyl]but-3-enoic acid Formula: C20H24O2S MolecularWeight: 328.46836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCC2=CC=C(S2)C=CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCC2=CC=C(S2)/C=C/CC(=O)O

InChI

InChI=1S/C20H24O2S/c21-20(22)14-8-13-19-16-15-18(23-19)12-7-2-1-4-9-17-10-5-3-6-11-17/h3,5-6,8,10-11,13,15-16H,1-2,4,7,9,12,14H2,(H,21,22)/b13-8+