(E)-5-(2-chloranyl-4-methyl-phenyl)-3-methyl-pent-4-enoate

Systemtic Name: (E)-5-(2-chloranyl-4-methyl-phenyl)-3-methyl-pent-4-enoate Openeye Name: (E)-5-(2-chloro-4-methyl-phenyl)-3-methyl-pent-4-enoate CAS Name: (E)-5-(2-chloro-4-methylphenyl)-3-methyl-4-pentenoate IUPAC Name: (E)-5-(2-chloro-4-methylphenyl)-3-methylpent-4-enoate Traditional Name: (E)-5-(2-chloro-4-methyl-phenyl)-3-methyl-pent-4-enoate Formula: C13H14ClO2- MolecularWeight: 237.70206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CC(C)CC(=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/C(C)CC(=O)[O-])Cl

InChI

InChI=1S/C13H15ClO2/c1-9-3-5-11(12(14)7-9)6-4-10(2)8-13(15)16/h3-7,10H,8H2,1-2H3,(H,15,16)/p-1/b6-4+