(E)-3-[5-(9-methoxy-9-oxidanylidene-nonyl)thiophen-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-(9-methoxy-9-oxidanylidene-nonyl)thiophen-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-(9-methoxy-9-oxo-nonyl)-2-thienyl]prop-2-enoic acid CAS Name: (E)-3-[5-(9-methoxy-9-oxononyl)-2-thiophenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-(9-methoxy-9-oxononyl)thiophen-2-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-(9-keto-9-methoxy-nonyl)-2-thienyl]acrylic acid Formula: C17H24O4S MolecularWeight: 324.43506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCC1=CC=C(S1)C=CC(=O)O

Isomeric SMILES

COC(=O)CCCCCCCCC1=CC=C(S1)/C=C/C(=O)O

InChI

InChI=1S/C17H24O4S/c1-21-17(20)9-7-5-3-2-4-6-8-14-10-11-15(22-14)12-13-16(18)19/h10-13H,2-9H2,1H3,(H,18,19)/b13-12+