(phenylmethyl) (4S,5R)-2,2-dimethyl-4-(2-methylpropyl)-5-[(1S)-1-oxidanylpentyl]-1,3-oxazolidine-3-carboxylate

Systemtic Name: (phenylmethyl) (4S,5R)-2,2-dimethyl-4-(2-methylpropyl)-5-[(1S)-1-oxidanylpentyl]-1,3-oxazolidine-3-carboxylate Openeye Name: benzyl (4S,5R)-5-[(1S)-1-hydroxypentyl]-4-isobutyl-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S,5R)-5-[(1S)-1-hydroxypentyl]-2,2-dimethyl-4-(2-methylpropyl)-3-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S,5R)-5-[(1S)-1-hydroxypentyl]-2,2-dimethyl-4-(2-methylpropyl)-1,3-oxazolidine-3-carboxylate Traditional Name: (4S,5R)-5-[(1S)-1-hydroxypentyl]-4-isobutyl-2,2-dimethyl-oxazolidine-3-carboxylic acid benzyl ester Formula: C22H35NO4 MolecularWeight: 377.5176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1C(N(C(O1)(C)C)C(=O)OCC2=CC=CC=C2)CC(C)C)O

Isomeric SMILES

CCCC[C@@H]([C@H]1[C@@H](N(C(O1)(C)C)C(=O)OCC2=CC=CC=C2)CC(C)C)O

InChI

InChI=1S/C22H35NO4/c1-6-7-13-19(24)20-18(14-16(2)3)23(22(4,5)27-20)21(25)26-15-17-11-9-8-10-12-17/h8-12,16,18-20,24H,6-7,13-15H2,1-5H3/t18-,19-,20+/m0/s1