dimethyl (1S,3S,4R)-4-acetamidocyclohexane-1,3-dicarboxylate

Systemtic Name: dimethyl (1S,3S,4R)-4-acetamidocyclohexane-1,3-dicarboxylate Openeye Name: dimethyl (1S,3S,4R)-4-acetamidocyclohexane-1,3-dicarboxylate CAS Name: (1S,3S,4R)-4-acetamidocyclohexane-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,3S,4R)-4-acetamidocyclohexane-1,3-dicarboxylate Traditional Name: (1S,3S,4R)-4-acetamidocyclohexane-1,3-dicarboxylic acid dimethyl ester Formula: C12H19NO5 MolecularWeight: 257.28296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC(CC1C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H]1CC[C@@H](C[C@@H]1C(=O)OC)C(=O)OC

InChI

InChI=1S/C12H19NO5/c1-7(14)13-10-5-4-8(11(15)17-2)6-9(10)12(16)18-3/h8-10H,4-6H2,1-3H3,(H,13,14)/t8-,9-,10+/m0/s1