methyl 1-[2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-keto-ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C15H26N3O3+ MolecularWeight: 296.38524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C[NH+]1CCC(CC1)C(=O)OC

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)C[NH+]1CCC(CC1)C(=O)OC

InChI

InChI=1S/C15H25N3O3/c1-11(2)15(3,10-16)17-13(19)9-18-7-5-12(6-8-18)14(20)21-4/h11-12H,5-9H2,1-4H3,(H,17,19)/p+1/t15-/m0/s1