methyl (E)-3-(2-tridec-1-ynylphenyl)prop-2-enoate

Systemtic Name: methyl (E)-3-(2-tridec-1-ynylphenyl)prop-2-enoate Openeye Name: methyl (E)-3-(2-tridec-1-ynylphenyl)prop-2-enoate CAS Name: (E)-3-(2-tridec-1-ynylphenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-tridec-1-ynylphenyl)prop-2-enoate Traditional Name: (E)-3-(2-tridec-1-ynylphenyl)acrylic acid methyl ester Formula: C23H32O2 MolecularWeight: 340.49898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CC1=CC=CC=C1C=CC(=O)OC

Isomeric SMILES

CCCCCCCCCCCC#CC1=CC=CC=C1/C=C/C(=O)OC

InChI

InChI=1S/C23H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-21-17-14-15-18-22(21)19-20-23(24)25-2/h14-15,17-20H,3-12H2,1-2H3/b20-19+