(E)-3-[4-(4-hexylcyclohexyl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(4-hexylcyclohexyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(4-hexylcyclohexyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(4-hexylcyclohexyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(4-hexylcyclohexyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(4-hexylcyclohexyl)phenyl]acrylic acid Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C21H30O2/c1-2-3-4-5-6-17-7-12-19(13-8-17)20-14-9-18(10-15-20)11-16-21(22)23/h9-11,14-17,19H,2-8,12-13H2,1H3,(H,22,23)/b16-11+