4-[(2S)-2-methylpiperidin-1-ium-1-yl]butan-2-one

Systemtic Name: 4-[(2S)-2-methylpiperidin-1-ium-1-yl]butan-2-one Openeye Name: 4-[(2S)-2-methylpiperidin-1-ium-1-yl]butan-2-one CAS Name: 4-[(2S)-2-methyl-1-piperidin-1-iumyl]-2-butanone IUPAC Name: 4-[(2S)-2-methylpiperidin-1-ium-1-yl]butan-2-one Traditional Name: 4-[(2S)-2-methylpiperidin-1-ium-1-yl]butan-2-one Formula: C10H20NO+ MolecularWeight: 170.2719

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C10H19NO/c1-9-5-3-4-7-11(9)8-6-10(2)12/h9H,3-8H2,1-2H3/p+1/t9-/m0/s1