(2S)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-(2-methylpropyl)propanamide

Systemtic Name: (2S)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-(2-methylpropyl)propanamide Openeye Name: (2S)-N-isobutyl-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]propanamide CAS Name: (2S)-2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-N-(2-methylpropyl)propanamide IUPAC Name: (2S)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-(2-methylpropyl)propanamide Traditional Name: (2S)-N-isobutyl-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]propionamide Formula: C16H34N3O+ MolecularWeight: 284.46066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCN[C@@H](C)C(=O)NCC(C)C

InChI

InChI=1S/C16H33N3O/c1-13(2)12-18-16(20)15(4)17-9-7-11-19-10-6-5-8-14(19)3/h13-15,17H,5-12H2,1-4H3,(H,18,20)/p+1/t14-,15-/m0/s1