(2S,3R,4S)-2,4-dimethyl-1-phenylmethoxy-hept-5-yn-3-ol

Systemtic Name: (2S,3R,4S)-2,4-dimethyl-1-phenylmethoxy-hept-5-yn-3-ol Openeye Name: (2S,3R,4S)-1-benzyloxy-2,4-dimethyl-hept-5-yn-3-ol CAS Name: (2S,3R,4S)-2,4-dimethyl-1-phenylmethoxy-5-heptyn-3-ol IUPAC Name: (2S,3R,4S)-2,4-dimethyl-1-phenylmethoxyhept-5-yn-3-ol Traditional Name: (2S,3R,4S)-1-benzoxy-2,4-dimethyl-hept-5-yn-3-ol Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C)C(C(C)COCC1=CC=CC=C1)O

Isomeric SMILES

CC#C[C@H](C)[C@H]([C@@H](C)COCC1=CC=CC=C1)O

InChI

InChI=1S/C16H22O2/c1-4-8-13(2)16(17)14(3)11-18-12-15-9-6-5-7-10-15/h5-7,9-10,13-14,16-17H,11-12H2,1-3H3/t13-,14-,16+/m0/s1