4-[(5E)-hepta-1,5-dien-4-yl]oxybut-2-ynyl benzoate

Systemtic Name: 4-[(5E)-hepta-1,5-dien-4-yl]oxybut-2-ynyl benzoate Openeye Name: 4-[(E)-1-allylbut-2-enoxy]but-2-ynyl benzoate CAS Name: benzoic acid 4-[(5E)-hepta-1,5-dien-4-yl]oxybut-2-ynyl ester IUPAC Name: 4-[(5E)-hepta-1,5-dien-4-yl]oxybut-2-ynyl benzoate Traditional Name: benzoic acid 4-[(E)-1-allylbut-2-enoxy]but-2-ynyl ester Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(CC=C)OCC#CCOC(=O)C1=CC=CC=C1

Isomeric SMILES

C/C=C/C(CC=C)OCC#CCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H20O3/c1-3-10-17(11-4-2)20-14-8-9-15-21-18(19)16-12-6-5-7-13-16/h3-7,11-13,17H,1,10,14-15H2,2H3/b11-4+