(1R,2S)-2-[3-(dimethylazaniumyl)propylcarbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[3-(dimethylazaniumyl)propylcarbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[3-(dimethylammonio)propylcarbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[3-(dimethylammonio)propylamino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[3-(dimethylazaniumyl)propylcarbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[3-(dimethylammonio)propylcarbamoyl]cyclohexanecarboxylate Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1CCCCC1C(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCNC(=O)[C@H]1CCCC[C@H]1C(=O)[O-]

InChI

InChI=1S/C13H24N2O3/c1-15(2)9-5-8-14-12(16)10-6-3-4-7-11(10)13(17)18/h10-11H,3-9H2,1-2H3,(H,14,16)(H,17,18)/t10-,11+/m0/s1