1-[[(3S,4S,5R)-3,5-dimethyl-1-phenylmethoxy-oct-7-yn-4-yl]oxymethyl]-4-methoxy-benzene

Systemtic Name: 1-[[(3S,4S,5R)-3,5-dimethyl-1-phenylmethoxy-oct-7-yn-4-yl]oxymethyl]-4-methoxy-benzene Openeye Name: 1-[[(1S,2R)-1-[(1S)-3-benzyloxy-1-methyl-propyl]-2-methyl-pent-4-ynoxy]methyl]-4-methoxy-benzene CAS Name: 1-[[(3S,4S,5R)-3,5-dimethyl-1-phenylmethoxyoct-7-yn-4-yl]oxymethyl]-4-methoxybenzene IUPAC Name: 1-[[(3S,4S,5R)-3,5-dimethyl-1-phenylmethoxyoct-7-yn-4-yl]oxymethyl]-4-methoxybenzene Traditional Name: 1-[[(1S,2R)-1-[(1S)-3-benzoxy-1-methyl-propyl]-2-methyl-pent-4-ynoxy]methyl]-4-methoxy-benzene Formula: C25H32O3 MolecularWeight: 380.51978

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOCC1=CC=CC=C1)C(C(C)CC#C)OCC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@@H](CCOCC1=CC=CC=C1)[C@H]([C@H](C)CC#C)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C25H32O3/c1-5-9-20(2)25(28-19-23-12-14-24(26-4)15-13-23)21(3)16-17-27-18-22-10-7-6-8-11-22/h1,6-8,10-15,20-21,25H,9,16-19H2,2-4H3/t20-,21+,25+/m1/s1