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

Systemtic Name: [(2S)-1-[(4-carboxycyclohexyl)methylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium chloride Openeye Name: [(1S)-1-[(4-carboxycyclohexyl)methylcarbamoyl]-3-methyl-butyl]ammonium chloride CAS Name: [(2S)-1-[(4-carboxycyclohexyl)methylamino]-4-methyl-1-oxopentan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-[(4-carboxycyclohexyl)methylamino]-4-methyl-1-oxopentan-2-yl]azanium chloride Traditional Name: [(1S)-1-[(4-carboxycyclohexyl)methylcarbamoyl]-3-methyl-butyl]ammonium chloride Formula: C14H27ClN2O3 MolecularWeight: 306.82878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H26N2O3.ClH/c1-9(2)7-12(15)13(17)16-8-10-3-5-11(6-4-10)14(18)19;/h9-12H,3-8,15H2,1-2H3,(H,16,17)(H,18,19);1H/t10?,11?,12-;/m0./s1