(E)-3-(6-methoxy-3-pentyl-1-benzothiophen-2-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(6-methoxy-3-pentyl-1-benzothiophen-2-yl)prop-2-enoic acid Openeye Name: (E)-3-(6-methoxy-3-pentyl-benzothiophen-2-yl)prop-2-enoic acid CAS Name: (E)-3-(6-methoxy-3-pentyl-1-benzothiophen-2-yl)-2-propenoic acid IUPAC Name: (E)-3-(6-methoxy-3-pentyl-1-benzothiophen-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(3-amyl-6-methoxy-benzothiophen-2-yl)acrylic acid Formula: C17H20O3S MolecularWeight: 304.4039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(SC2=C1C=CC(=C2)OC)C=CC(=O)O

Isomeric SMILES

CCCCCC1=C(SC2=C1C=CC(=C2)OC)/C=C/C(=O)O

InChI

InChI=1S/C17H20O3S/c1-3-4-5-6-13-14-8-7-12(20-2)11-16(14)21-15(13)9-10-17(18)19/h7-11H,3-6H2,1-2H3,(H,18,19)/b10-9+