4-ethyl-1-(propan-2-ylcarbamoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 4-ethyl-1-(propan-2-ylcarbamoylamino)cyclohexane-1-carboxylic acid Openeye Name: 4-ethyl-1-(isopropylcarbamoylamino)cyclohexanecarboxylic acid CAS Name: 4-ethyl-1-[[oxo-(propan-2-ylamino)methyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-ethyl-1-(propan-2-ylcarbamoylamino)cyclohexane-1-carboxylic acid Traditional Name: 4-ethyl-1-(isopropylcarbamoylamino)cyclohexanecarboxylic acid Formula: C13H24N2O3 MolecularWeight: 256.34126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)NC(C)C

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)NC(C)C

InChI

InChI=1S/C13H24N2O3/c1-4-10-5-7-13(8-6-10,11(16)17)15-12(18)14-9(2)3/h9-10H,4-8H2,1-3H3,(H,16,17)(H2,14,15,18)