(E)-3-[4-(cyclohexylmethyl)-2,2-dimethyl-1,3-oxazolidin-5-yl]-2-ethyl-4-oxidanylidene-4-phenylmethoxy-but-2-enoic acid

Systemtic Name: (E)-3-[4-(cyclohexylmethyl)-2,2-dimethyl-1,3-oxazolidin-5-yl]-2-ethyl-4-oxidanylidene-4-phenylmethoxy-but-2-enoic acid Openeye Name: (E)-4-benzyloxy-3-[4-(cyclohexylmethyl)-2,2-dimethyl-oxazolidin-5-yl]-2-ethyl-4-oxo-but-2-enoic acid CAS Name: (E)-3-[4-(cyclohexylmethyl)-2,2-dimethyl-5-oxazolidinyl]-2-ethyl-4-oxo-4-phenylmethoxy-2-butenoic acid IUPAC Name: (E)-3-[4-(cyclohexylmethyl)-2,2-dimethyl-1,3-oxazolidin-5-yl]-2-ethyl-4-oxo-4-phenylmethoxybut-2-enoic acid Traditional Name: (E)-4-benzoxy-3-[4-(cyclohexylmethyl)-2,2-dimethyl-oxazolidin-5-yl]-2-ethyl-4-keto-but-2-enoic acid Formula: C25H35NO5 MolecularWeight: 429.5491

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1C(NC(O1)(C)C)CC2CCCCC2)C(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC/C(=C(/C1C(NC(O1)(C)C)CC2CCCCC2)\C(=O)OCC3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C25H35NO5/c1-4-19(23(27)28)21(24(29)30-16-18-13-9-6-10-14-18)22-20(26-25(2,3)31-22)15-17-11-7-5-8-12-17/h6,9-10,13-14,17,20,22,26H,4-5,7-8,11-12,15-16H2,1-3H3,(H,27,28)/b21-19+