methyl (2E)-2-[(4-chlorophenyl)methylidene]hexanoate

Systemtic Name: methyl (2E)-2-[(4-chlorophenyl)methylidene]hexanoate Openeye Name: methyl (2E)-2-[(4-chlorophenyl)methylene]hexanoate CAS Name: (2E)-2-[(4-chlorophenyl)methylidene]hexanoic acid methyl ester IUPAC Name: methyl (2E)-2-[(4-chlorophenyl)methylidene]hexanoate Traditional Name: (E)-2-butyl-3-(4-chlorophenyl)acrylic acid methyl ester Formula: C14H17ClO2 MolecularWeight: 252.73658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC1=CC=C(C=C1)Cl)C(=O)OC

Isomeric SMILES

CCCC/C(=C\C1=CC=C(C=C1)Cl)/C(=O)OC

InChI

InChI=1S/C14H17ClO2/c1-3-4-5-12(14(16)17-2)10-11-6-8-13(15)9-7-11/h6-10H,3-5H2,1-2H3/b12-10+