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

Systemtic Name: (E)-3-(3,5-dimethyl-4-propoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3,5-dimethyl-4-propoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3,5-dimethyl-4-propoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3,5-dimethyl-4-propoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3,5-dimethyl-4-propoxy-phenyl)acrylic acid Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C)C=CC(=O)O)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1C)/C=C/C(=O)O)C

InChI

InChI=1S/C14H18O3/c1-4-7-17-14-10(2)8-12(9-11(14)3)5-6-13(15)16/h5-6,8-9H,4,7H2,1-3H3,(H,15,16)/b6-5+