(E)-3-(5-oct-1-ynylthiophen-2-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(5-oct-1-ynylthiophen-2-yl)prop-2-enoic acid Openeye Name: (E)-3-(5-oct-1-ynyl-2-thienyl)prop-2-enoic acid CAS Name: (E)-3-(5-oct-1-ynyl-2-thiophenyl)-2-propenoic acid IUPAC Name: (E)-3-(5-oct-1-ynylthiophen-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(5-oct-1-ynyl-2-thienyl)acrylic acid Formula: C15H18O2S MolecularWeight: 262.36722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC=C(S1)C=CC(=O)O

Isomeric SMILES

CCCCCCC#CC1=CC=C(S1)/C=C/C(=O)O

InChI

InChI=1S/C15H18O2S/c1-2-3-4-5-6-7-8-13-9-10-14(18-13)11-12-15(16)17/h9-12H,2-6H2,1H3,(H,16,17)/b12-11+