methyl (2E)-5-methoxy-2-(phenylmethylidene)pent-3-ynoate

Systemtic Name: methyl (2E)-5-methoxy-2-(phenylmethylidene)pent-3-ynoate Openeye Name: methyl (2E)-2-benzylidene-5-methoxy-pent-3-ynoate CAS Name: (2E)-5-methoxy-2-(phenylmethylene)-3-pentynoic acid methyl ester IUPAC Name: methyl (2E)-2-benzylidene-5-methoxypent-3-ynoate Traditional Name: (2E)-2-benzal-5-methoxy-pent-3-ynoic acid methyl ester Formula: C14H14O3 MolecularWeight: 230.25916

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Descriptors Computed from Structure

Canonical SMILES:

COCC#CC(=CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H14O3/c1-16-10-6-9-13(14(15)17-2)11-12-7-4-3-5-8-12/h3-5,7-8,11H,10H2,1-2H3/b13-11+