(E)-3-(3,5-dimethyl-4-pentoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3,5-dimethyl-4-pentoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3,5-dimethyl-4-pentoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3,5-dimethyl-4-pentoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3,5-dimethyl-4-pentoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-amoxy-3,5-dimethyl-phenyl)acrylic acid Formula: C16H22O3 MolecularWeight: 262.34408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1C)C=CC(=O)O)C

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1C)/C=C/C(=O)O)C

InChI

InChI=1S/C16H22O3/c1-4-5-6-9-19-16-12(2)10-14(11-13(16)3)7-8-15(17)18/h7-8,10-11H,4-6,9H2,1-3H3,(H,17,18)/b8-7+