1-(2-phenylbut-3-yn-2-yloxymethyl)cyclohepta-1,3,5-triene

Systemtic Name: 1-(2-phenylbut-3-yn-2-yloxymethyl)cyclohepta-1,3,5-triene Openeye Name: 1-[(1-methyl-1-phenyl-prop-2-ynoxy)methyl]cyclohepta-1,3,5-triene CAS Name: 1-(2-phenylbut-3-yn-2-yloxymethyl)cyclohepta-1,3,5-triene IUPAC Name: 1-(2-phenylbut-3-yn-2-yloxymethyl)cyclohepta-1,3,5-triene Traditional Name: 1-[(1-methyl-1-phenyl-prop-2-ynoxy)methyl]cyclohepta-1,3,5-triene Formula: C18H18O MolecularWeight: 250.33492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)(C1=CC=CC=C1)OCC2=CC=CC=CC2

Isomeric SMILES

CC(C#C)(C1=CC=CC=C1)OCC2=CC=CC=CC2

InChI

InChI=1S/C18H18O/c1-3-18(2,17-13-9-6-10-14-17)19-15-16-11-7-4-5-8-12-16/h1,4-11,13-14H,12,15H2,2H3