(E,4R,5S)-4,6-dimethyl-1-phenylmethoxy-undec-6-en-2-yn-5-ol

Systemtic Name: (E,4R,5S)-4,6-dimethyl-1-phenylmethoxy-undec-6-en-2-yn-5-ol Openeye Name: (E,4R,5S)-1-benzyloxy-4,6-dimethyl-undec-6-en-2-yn-5-ol CAS Name: (E,4R,5S)-4,6-dimethyl-1-phenylmethoxy-5-undec-6-en-2-ynol IUPAC Name: (E,4R,5S)-4,6-dimethyl-1-phenylmethoxyundec-6-en-2-yn-5-ol Traditional Name: (E,4R,5S)-1-benzoxy-4,6-dimethyl-undec-6-en-2-yn-5-ol Formula: C20H28O2 MolecularWeight: 300.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=C(C)C(C(C)C#CCOCC1=CC=CC=C1)O

Isomeric SMILES

CCCC/C=C(\C)/[C@H]([C@H](C)C#CCOCC1=CC=CC=C1)O

InChI

InChI=1S/C20H28O2/c1-4-5-7-11-17(2)20(21)18(3)12-10-15-22-16-19-13-8-6-9-14-19/h6,8-9,11,13-14,18,20-21H,4-5,7,15-16H2,1-3H3/b17-11+/t18-,20-/m1/s1