oct-3-yn-2-yl (E)-3-phenylprop-2-enoate

Systemtic Name: oct-3-yn-2-yl (E)-3-phenylprop-2-enoate Openeye Name: 1-methylhept-2-ynyl (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid oct-3-yn-2-yl ester IUPAC Name: oct-3-yn-2-yl (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid 1-methylhept-2-ynyl ester Formula: C17H20O2 MolecularWeight: 256.3395

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC#CC(C)OC(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C17H20O2/c1-3-4-5-7-10-15(2)19-17(18)14-13-16-11-8-6-9-12-16/h6,8-9,11-15H,3-5H2,1-2H3/b14-13+