(E)-3-(6-butoxy-6-oxidanyl-cyclohexa-2,4-dien-1-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(6-butoxy-6-oxidanyl-cyclohexa-2,4-dien-1-yl)prop-2-enoic acid Openeye Name: (E)-3-(6-butoxy-6-hydroxy-cyclohexa-2,4-dien-1-yl)prop-2-enoic acid CAS Name: (E)-3-(6-butoxy-6-hydroxy-1-cyclohexa-2,4-dienyl)-2-propenoic acid IUPAC Name: (E)-3-(6-butoxy-6-hydroxycyclohexa-2,4-dien-1-yl)prop-2-enoic acid Traditional Name: (E)-3-(6-butoxy-6-hydroxy-cyclohexa-2,4-dien-1-yl)acrylic acid Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1(C=CC=CC1C=CC(=O)O)O

Isomeric SMILES

CCCCOC1(C=CC=CC1/C=C/C(=O)O)O

InChI

InChI=1S/C13H18O4/c1-2-3-10-17-13(16)9-5-4-6-11(13)7-8-12(14)15/h4-9,11,16H,2-3,10H2,1H3,(H,14,15)/b8-7+