methyl (E)-3,6-diphenylhex-2-en-5-ynoate

Systemtic Name: methyl (E)-3,6-diphenylhex-2-en-5-ynoate Openeye Name: methyl (E)-3,6-diphenylhex-2-en-5-ynoate CAS Name: (E)-3,6-diphenylhex-2-en-5-ynoic acid methyl ester IUPAC Name: methyl (E)-3,6-diphenylhex-2-en-5-ynoate Traditional Name: (E)-3,6-diphenylhex-2-en-5-ynoic acid methyl ester Formula: C19H16O2 MolecularWeight: 276.32914

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(CC#CC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)/C=C(\CC#CC1=CC=CC=C1)/C2=CC=CC=C2

InChI

InChI=1S/C19H16O2/c1-21-19(20)15-18(17-12-6-3-7-13-17)14-8-11-16-9-4-2-5-10-16/h2-7,9-10,12-13,15H,14H2,1H3/b18-15+