1-[[(2S,3R,4S)-2,4-dimethyl-1-phenylmethoxy-hept-5-yn-3-yl]oxymethyl]-4-methoxy-benzene

Systemtic Name: 1-[[(2S,3R,4S)-2,4-dimethyl-1-phenylmethoxy-hept-5-yn-3-yl]oxymethyl]-4-methoxy-benzene Openeye Name: 1-[[(1R,2S)-1-[(1S)-2-benzyloxy-1-methyl-ethyl]-2-methyl-pent-3-ynoxy]methyl]-4-methoxy-benzene CAS Name: 1-[[(2S,3R,4S)-2,4-dimethyl-1-phenylmethoxyhept-5-yn-3-yl]oxymethyl]-4-methoxybenzene IUPAC Name: 1-[[(2S,3R,4S)-2,4-dimethyl-1-phenylmethoxyhept-5-yn-3-yl]oxymethyl]-4-methoxybenzene Traditional Name: 1-[[(1R,2S)-1-[(1S)-2-benzoxy-1-methyl-ethyl]-2-methyl-pent-3-ynoxy]methyl]-4-methoxy-benzene Formula: C24H30O3 MolecularWeight: 366.4932

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C)C(C(C)COCC1=CC=CC=C1)OCC2=CC=C(C=C2)OC

Isomeric SMILES

CC#C[C@H](C)[C@H]([C@@H](C)COCC1=CC=CC=C1)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C24H30O3/c1-5-9-19(2)24(27-18-22-12-14-23(25-4)15-13-22)20(3)16-26-17-21-10-7-6-8-11-21/h6-8,10-15,19-20,24H,16-18H2,1-4H3/t19-,20-,24+/m0/s1