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

Systemtic Name: (E)-3-[4-[4-(4-methylpentoxy)phenyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(4-isohexyloxyphenyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[4-(4-methylpentoxy)phenyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[4-(4-methylpentoxy)phenyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(4-isohexyloxyphenyl)phenyl]acrylic acid Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

CC(C)CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C21H24O3/c1-16(2)4-3-15-24-20-12-10-19(11-13-20)18-8-5-17(6-9-18)7-14-21(22)23/h5-14,16H,3-4,15H2,1-2H3,(H,22,23)/b14-7+