2-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one

Systemtic Name: 2-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Openeye Name: 2-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one CAS Name: 2-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-1-propanone IUPAC Name: 2-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Traditional Name: 2-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Formula: C10H21N2O+ MolecularWeight: 185.28654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC[NH+](CC1)C

Isomeric SMILES

CC(C)C(=O)N1CCC[NH+](CC1)C

InChI

InChI=1S/C10H20N2O/c1-9(2)10(13)12-6-4-5-11(3)7-8-12/h9H,4-8H2,1-3H3/p+1