(E)-3-[5-(4-phenylbutyl)thiophen-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-(4-phenylbutyl)thiophen-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-(4-phenylbutyl)-2-thienyl]prop-2-enoic acid CAS Name: (E)-3-[5-(4-phenylbutyl)-2-thiophenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-(4-phenylbutyl)thiophen-2-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-(4-phenylbutyl)-2-thienyl]acrylic acid Formula: C17H18O2S MolecularWeight: 286.38862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC2=CC=C(S2)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCC2=CC=C(S2)/C=C/C(=O)O

InChI

InChI=1S/C17H18O2S/c18-17(19)13-12-16-11-10-15(20-16)9-5-4-8-14-6-2-1-3-7-14/h1-3,6-7,10-13H,4-5,8-9H2,(H,18,19)/b13-12+