1-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]-4-prop-2-enoxy-benzene

Systemtic Name: 1-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]-4-prop-2-enoxy-benzene Openeye Name: 1-allyloxy-4-[1-ethynyl-1-methyl-4-(3-phenoxyphenyl)butyl]benzene CAS Name: 1-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]-4-prop-2-enoxybenzene IUPAC Name: 1-[3-methyl-6-(3-phenoxyphenyl)hex-1-yn-3-yl]-4-prop-2-enoxybenzene Traditional Name: 1-allyloxy-4-[1-methyl-1-[3-(3-phenoxyphenyl)propyl]prop-2-ynyl]benzene Formula: C28H28O2 MolecularWeight: 396.52072

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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)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C28H28O2/c1-4-21-29-25-18-16-24(17-19-25)28(3,5-2)20-10-12-23-11-9-15-27(22-23)30-26-13-7-6-8-14-26/h2,4,6-9,11,13-19,22H,1,10,12,20-21H2,3H3