(2S)-2-bromanyl-3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]butanamide

Systemtic Name: (2S)-2-bromanyl-3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]butanamide Openeye Name: (2S)-2-bromo-3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]butanamide CAS Name: (2S)-2-bromo-3-methyl-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]butanamide IUPAC Name: (2S)-2-bromo-3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]butanamide Traditional Name: (2S)-2-bromo-3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]butyramide Formula: C14H28BrN2O+ MolecularWeight: 320.28892

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C(C(C)C)Br

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)[C@H](C(C)C)Br

InChI

InChI=1S/C14H27BrN2O/c1-11(2)13(15)14(18)16-8-6-10-17-9-5-4-7-12(17)3/h11-13H,4-10H2,1-3H3,(H,16,18)/p+1/t12-,13-/m0/s1