4-(cyclohexylmethyl)-5-(2-ethyl-3-methyl-2-phenylmethoxy-butyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylic acid

Systemtic Name: 4-(cyclohexylmethyl)-5-(2-ethyl-3-methyl-2-phenylmethoxy-butyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylic acid Openeye Name: 5-(2-benzyloxy-2-ethyl-3-methyl-butyl)-4-(cyclohexylmethyl)-2,2-dimethyl-oxazolidine-3-carboxylic acid CAS Name: 4-(cyclohexylmethyl)-5-(2-ethyl-3-methyl-2-phenylmethoxybutyl)-2,2-dimethyl-3-oxazolidinecarboxylic acid IUPAC Name: 4-(cyclohexylmethyl)-5-(2-ethyl-3-methyl-2-phenylmethoxybutyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylic acid Traditional Name: 5-(2-benzoxy-2-ethyl-3-methyl-butyl)-4-(cyclohexylmethyl)-2,2-dimethyl-oxazolidine-3-carboxylic acid Formula: C27H43NO4 MolecularWeight: 445.63462

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1C(N(C(O1)(C)C)C(=O)O)CC2CCCCC2)(C(C)C)OCC3=CC=CC=C3

Isomeric SMILES

CCC(CC1C(N(C(O1)(C)C)C(=O)O)CC2CCCCC2)(C(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C27H43NO4/c1-6-27(20(2)3,31-19-22-15-11-8-12-16-22)18-24-23(17-21-13-9-7-10-14-21)28(25(29)30)26(4,5)32-24/h8,11-12,15-16,20-21,23-24H,6-7,9-10,13-14,17-19H2,1-5H3,(H,29,30)