(E)-3-(2-chloranyl-6-octan-2-yloxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-chloranyl-6-octan-2-yloxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-[2-chloro-6-(1-methylheptoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-(2-chloro-6-octan-2-yloxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(2-chloro-6-octan-2-yloxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-[2-chloro-6-(1-methylheptoxy)phenyl]acrylic acid Formula: C17H23ClO3 MolecularWeight: 310.81572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=C(C(=CC=C1)Cl)C=CC(=O)O

Isomeric SMILES

CCCCCCC(C)OC1=C(C(=CC=C1)Cl)/C=C/C(=O)O

InChI

InChI=1S/C17H23ClO3/c1-3-4-5-6-8-13(2)21-16-10-7-9-15(18)14(16)11-12-17(19)20/h7,9-13H,3-6,8H2,1-2H3,(H,19,20)/b12-11+