methyl (E,5E)-5-[(4-methylphenyl)methylidene]hept-3-enoate

Systemtic Name: methyl (E,5E)-5-[(4-methylphenyl)methylidene]hept-3-enoate Openeye Name: methyl (E,5E)-5-(p-tolylmethylene)hept-3-enoate CAS Name: (E,5E)-5-[(4-methylphenyl)methylidene]-3-heptenoic acid methyl ester IUPAC Name: methyl (E,5E)-5-[(4-methylphenyl)methylidene]hept-3-enoate Traditional Name: (3E,5E)-5-ethyl-6-(p-tolyl)hexa-3,5-dienoic acid methyl ester Formula: C16H20O2 MolecularWeight: 244.3288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC=C(C=C1)C)C=CCC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H20O2/c1-4-14(6-5-7-16(17)18-3)12-15-10-8-13(2)9-11-15/h5-6,8-12H,4,7H2,1-3H3/b6-5+,14-12+