4-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]phenol

Systemtic Name: 4-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]phenol Openeye Name: 4-[1-ethynyl-1-methyl-4-(3-phenoxyphenyl)butyl]phenol CAS Name: 4-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]phenol IUPAC Name: 4-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]phenol Traditional Name: 4-[1-methyl-1-[3-(3-phenoxyphenyl)propyl]prop-2-ynyl]phenol Formula: C25H24O2 MolecularWeight: 356.45686

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)(C#C)C3=CC=C(C=C3)O

Isomeric SMILES

CC(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)(C#C)C3=CC=C(C=C3)O

InChI

InChI=1S/C25H24O2/c1-3-25(2,21-14-16-22(26)17-15-21)18-8-10-20-9-7-13-24(19-20)27-23-11-5-4-6-12-23/h1,4-7,9,11-17,19,26H,8,10,18H2,2H3