[(E)-5-ethoxycarbonyl-5-methyl-7-phenyl-hept-2-en-6-ynyl] benzoate

Systemtic Name: [(E)-5-ethoxycarbonyl-5-methyl-7-phenyl-hept-2-en-6-ynyl] benzoate Openeye Name: [(E)-5-ethoxycarbonyl-5-methyl-7-phenyl-hept-2-en-6-ynyl] benzoate CAS Name: benzoic acid [(E)-5-ethoxycarbonyl-5-methyl-7-phenylhept-2-en-6-ynyl] ester IUPAC Name: [(E)-5-ethoxycarbonyl-5-methyl-7-phenylhept-2-en-6-ynyl] benzoate Traditional Name: benzoic acid [(E)-5-carbethoxy-5-methyl-7-phenyl-hept-2-en-6-ynyl] ester Formula: C24H24O4 MolecularWeight: 376.44496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC=CCOC(=O)C1=CC=CC=C1)C#CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C)(C/C=C/COC(=O)C1=CC=CC=C1)C#CC2=CC=CC=C2

InChI

InChI=1S/C24H24O4/c1-3-27-23(26)24(2,18-16-20-12-6-4-7-13-20)17-10-11-19-28-22(25)21-14-8-5-9-15-21/h4-15H,3,17,19H2,1-2H3/b11-10+