[(2S)-1-[(4-carboxycyclohexyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium chloride

Systemtic Name: [(2S)-1-[(4-carboxycyclohexyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium chloride Openeye Name: [(1S)-1-[(4-carboxycyclohexyl)methylcarbamoyl]-2-methyl-propyl]ammonium chloride CAS Name: [(2S)-1-[(4-carboxycyclohexyl)methylamino]-3-methyl-1-oxobutan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-[(4-carboxycyclohexyl)methylamino]-3-methyl-1-oxobutan-2-yl]azanium chloride Traditional Name: [(1S)-1-[(4-carboxycyclohexyl)methylcarbamoyl]-2-methyl-propyl]ammonium chloride Formula: C13H25ClN2O3 MolecularWeight: 292.8022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H24N2O3.ClH/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);1H/t9?,10?,11-;/m0./s1