(2S)-1-[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-3-methyl-2-(4-methyl-1-piperidin-1-iumyl)-1-oxobutyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate Formula: C16H28N2O3 MolecularWeight: 296.40512

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C(C)C)C(=O)N2CCCC2C(=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](C(C)C)C(=O)N2CCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C16H28N2O3/c1-11(2)14(17-9-6-12(3)7-10-17)15(19)18-8-4-5-13(18)16(20)21/h11-14H,4-10H2,1-3H3,(H,20,21)/t13-,14-/m0/s1