1-(butylcarbamoylamino)-4-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-(butylcarbamoylamino)-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-(butylcarbamoylamino)-4-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[butylamino(oxo)methyl]amino]-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-(butylcarbamoylamino)-4-methylcyclohexane-1-carboxylic acid Traditional Name: 1-(butylcarbamoylamino)-4-methyl-cyclohexanecarboxylic acid Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1(CCC(CC1)C)C(=O)O

Isomeric SMILES

CCCCNC(=O)NC1(CCC(CC1)C)C(=O)O

InChI

InChI=1S/C13H24N2O3/c1-3-4-9-14-12(18)15-13(11(16)17)7-5-10(2)6-8-13/h10H,3-9H2,1-2H3,(H,16,17)(H2,14,15,18)