(E)-3-[3-methyl-4-(oxan-2-yloxy)-1-benzofuran-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-methyl-4-(oxan-2-yloxy)-1-benzofuran-2-yl]prop-2-enoic acid Openeye Name: (E)-3-(3-methyl-4-tetrahydropyran-2-yloxy-benzofuran-2-yl)prop-2-enoic acid CAS Name: (E)-3-[3-methyl-4-(2-oxanyloxy)-2-benzofuranyl]-2-propenoic acid IUPAC Name: (E)-3-[3-methyl-4-(oxan-2-yloxy)-1-benzofuran-2-yl]prop-2-enoic acid Traditional Name: (E)-3-(3-methyl-4-tetrahydropyran-2-yloxy-benzofuran-2-yl)acrylic acid Formula: C17H18O5 MolecularWeight: 302.32182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OC3CCCCO3)C=CC(=O)O

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OC3CCCCO3)/C=C/C(=O)O

InChI

InChI=1S/C17H18O5/c1-11-12(8-9-15(18)19)21-13-5-4-6-14(17(11)13)22-16-7-2-3-10-20-16/h4-6,8-9,16H,2-3,7,10H2,1H3,(H,18,19)/b9-8+