(E)-3-[3-(2-methylpropoxy)-2-oxidanyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-(2-methylpropoxy)-2-oxidanyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-(2-hydroxy-3-isobutoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-[2-hydroxy-3-(2-methylpropoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-hydroxy-3-(2-methylpropoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-(2-hydroxy-3-isobutoxy-phenyl)acrylic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1O)C=CC(=O)O

Isomeric SMILES

CC(C)COC1=CC=CC(=C1O)/C=C/C(=O)O

InChI

InChI=1S/C13H16O4/c1-9(2)8-17-11-5-3-4-10(13(11)16)6-7-12(14)15/h3-7,9,16H,8H2,1-2H3,(H,14,15)/b7-6+