(E)-3-[5-chloranyl-2-(2-methylpropoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-chloranyl-2-(2-methylpropoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-(5-chloro-2-isobutoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-[5-chloro-2-(2-methylpropoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-chloro-2-(2-methylpropoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-(5-chloro-2-isobutoxy-phenyl)acrylic acid Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Cl)C=CC(=O)O

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Cl)/C=C/C(=O)O

InChI

InChI=1S/C13H15ClO3/c1-9(2)8-17-12-5-4-11(14)7-10(12)3-6-13(15)16/h3-7,9H,8H2,1-2H3,(H,15,16)/b6-3+