4-[[[(2R)-2-azaniumyl-3-methyl-butanoyl]amino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[[(2R)-2-azaniumyl-3-methyl-butanoyl]amino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[(2R)-2-azaniumyl-3-methyl-butanoyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[(2R)-2-ammonio-3-methyl-1-oxobutyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[(2R)-2-azaniumyl-3-methylbutanoyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[(2R)-2-ammonio-3-methyl-butanoyl]amino]methyl]cyclohexanecarboxylate Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1CCC(CC1)C(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)[C@H](C(=O)NCC1CCC(CC1)C(=O)[O-])[NH3+]

InChI

InChI=1S/C13H24N2O3/c1-8(2)11(14)12(16)15-7-9-3-5-10(6-4-9)13(17)18/h8-11H,3-7,14H2,1-2H3,(H,15,16)(H,17,18)/t9?,10?,11-/m1/s1