hept-1-yn-3-ol; [hept-1-yn-3-yloxy(diphenyl)methyl]benzene

Systemtic Name: hept-1-yn-3-ol; [hept-1-yn-3-yloxy(diphenyl)methyl]benzene Openeye Name: [1-ethynylpentoxy(diphenyl)methyl]benzene; hept-1-yn-3-ol CAS Name: 1-heptyn-3-ol; [hept-1-yn-3-yloxy(diphenyl)methyl]benzene IUPAC Name: hept-1-yn-3-ol; [hept-1-yn-3-yloxy(diphenyl)methyl]benzene Traditional Name: [1-butylprop-2-ynoxy(diphenyl)methyl]benzene; hept-1-yn-3-ol Formula: C33H38O2 MolecularWeight: 466.65362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C#C)O.CCCCC(C#C)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCC(C#C)O.CCCCC(C#C)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H26O.C7H12O/c1-3-5-21-25(4-2)27-26(22-15-9-6-10-16-22,23-17-11-7-12-18-23)24-19-13-8-14-20-24;1-3-5-6-7(8)4-2/h2,6-20,25H,3,5,21H2,1H3;2,7-8H,3,5-6H2,1H3