[(E,3S,4R)-5-methyl-8-phenyl-3-phenylmethoxy-4-propan-2-yl-oct-5-en-1-ynyl]benzene

Systemtic Name: [(E,3S,4R)-5-methyl-8-phenyl-3-phenylmethoxy-4-propan-2-yl-oct-5-en-1-ynyl]benzene Openeye Name: [(E,3S,4R)-3-benzyloxy-4-isopropyl-5-methyl-8-phenyl-oct-5-en-1-ynyl]benzene CAS Name: [(E,3S,4R)-5-methyl-8-phenyl-3-phenylmethoxy-4-propan-2-yloct-5-en-1-ynyl]benzene IUPAC Name: [(E,3S,4R)-5-methyl-8-phenyl-3-phenylmethoxy-4-propan-2-yloct-5-en-1-ynyl]benzene Traditional Name: [(E,3S,4R)-3-benzoxy-4-isopropyl-5-methyl-8-phenyl-oct-5-en-1-ynyl]benzene Formula: C31H34O MolecularWeight: 422.60106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C#CC1=CC=CC=C1)OCC2=CC=CC=C2)C(=CCCC3=CC=CC=C3)C

Isomeric SMILES

CC(C)[C@@H]([C@@H](C#CC1=CC=CC=C1)OCC2=CC=CC=C2)/C(=C/CCC3=CC=CC=C3)/C

InChI

InChI=1S/C31H34O/c1-25(2)31(26(3)14-13-21-27-15-7-4-8-16-27)30(23-22-28-17-9-5-10-18-28)32-24-29-19-11-6-12-20-29/h4-12,14-20,25,30-31H,13,21,24H2,1-3H3/b26-14+/t30-,31-/m1/s1