3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]azaniumyl]propanoate

Systemtic Name: 3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]azaniumyl]propanoate Openeye Name: 3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonio]propanoate CAS Name: 3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonio]propanoate IUPAC Name: 3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]azaniumyl]propanoate Traditional Name: 3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonio]propionate Formula: C11H21NO2 MolecularWeight: 199.28994

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]CCC(=O)[O-]

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)[NH2+]CCC(=O)[O-]

InChI

InChI=1S/C11H21NO2/c1-8-4-3-5-10(9(8)2)12-7-6-11(13)14/h8-10,12H,3-7H2,1-2H3,(H,13,14)/t8-,9+,10-/m0/s1