(4R,5R)-4-acetamido-5-(diethylcarbamoyl)cyclohexene-1-carboxylic acid

Systemtic Name: (4R,5R)-4-acetamido-5-(diethylcarbamoyl)cyclohexene-1-carboxylic acid Openeye Name: (4R,5R)-4-acetamido-5-(diethylcarbamoyl)cyclohexene-1-carboxylic acid CAS Name: (4R,5R)-4-acetamido-5-[diethylamino(oxo)methyl]-1-cyclohexenecarboxylic acid IUPAC Name: (4R,5R)-4-acetamido-5-(diethylcarbamoyl)cyclohexene-1-carboxylic acid Traditional Name: (4R,5R)-4-acetamido-5-(diethylcarbamoyl)cyclohexene-1-carboxylic acid Formula: C14H22N2O4 MolecularWeight: 282.33548

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CC(=CCC1NC(=O)C)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)[C@@H]1CC(=CC[C@H]1NC(=O)C)C(=O)O

InChI

InChI=1S/C14H22N2O4/c1-4-16(5-2)13(18)11-8-10(14(19)20)6-7-12(11)15-9(3)17/h6,11-12H,4-5,7-8H2,1-3H3,(H,15,17)(H,19,20)/t11-,12-/m1/s1