2-methyloct-5-yn-4-yl 2-phenylethanoate

Systemtic Name: 2-methyloct-5-yn-4-yl 2-phenylethanoate Openeye Name: 1-isobutylpent-2-ynyl 2-phenylacetate CAS Name: 2-phenylacetic acid 2-methyloct-5-yn-4-yl ester IUPAC Name: 2-methyloct-5-yn-4-yl 2-phenylacetate Traditional Name: 2-phenylacetic acid 1-isobutylpent-2-ynyl ester Formula: C17H22O2 MolecularWeight: 258.35538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22O2/c1-4-5-11-16(12-14(2)3)19-17(18)13-15-9-7-6-8-10-15/h6-10,14,16H,4,12-13H2,1-3H3