methyl (2E)-2-[1-(4-methylphenyl)ethylidene]hexanoate

Systemtic Name: methyl (2E)-2-[1-(4-methylphenyl)ethylidene]hexanoate Openeye Name: methyl (2E)-2-[1-(p-tolyl)ethylidene]hexanoate CAS Name: (2E)-2-[1-(4-methylphenyl)ethylidene]hexanoic acid methyl ester IUPAC Name: methyl (2E)-2-[1-(4-methylphenyl)ethylidene]hexanoate Traditional Name: (E)-2-butyl-3-(p-tolyl)but-2-enoic acid methyl ester Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O2/c1-5-6-7-15(16(17)18-4)13(3)14-10-8-12(2)9-11-14/h8-11H,5-7H2,1-4H3/b15-13+