(3S)-1-[2-[butyl(methyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-[2-[butyl(methyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid Openeye Name: (3S)-1-[2-[butyl(methyl)amino]-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: (3S)-1-[2-[butyl(methyl)amino]-2-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-[2-[butyl(methyl)amino]-2-oxoethyl]piperidine-3-carboxylic acid Traditional Name: (3S)-1-[2-[butyl(methyl)amino]-2-keto-ethyl]nipecotic acid Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CN1CCCC(C1)C(=O)O

Isomeric SMILES

CCCCN(C)C(=O)CN1CCC[C@@H](C1)C(=O)O

InChI

InChI=1S/C13H24N2O3/c1-3-4-7-14(2)12(16)10-15-8-5-6-11(9-15)13(17)18/h11H,3-10H2,1-2H3,(H,17,18)/t11-/m0/s1