(E)-3-(3-butoxy-2-oxidanyl-phenyl)prop-2-enoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1O)C=CC(=O)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1O)/C=C/C(=O)O

InChI

InChI=1S/C13H16O4/c1-2-3-9-17-11-6-4-5-10(13(11)16)7-8-12(14)15/h4-8,16H,2-3,9H2,1H3,(H,14,15)/b8-7+