(2S)-2-bromanyl-3-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one

Systemtic Name: (2S)-2-bromanyl-3-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one Openeye Name: (2S)-2-bromo-3-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one CAS Name: (2S)-2-bromo-3-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-1-butanone IUPAC Name: (2S)-2-bromo-3-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one Traditional Name: (2S)-2-bromo-3-methyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)butan-1-one Formula: C11H22BrN2O+ MolecularWeight: 278.20918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H21BrN2O/c1-9(2)10(12)11(15)14-6-4-5-13(3)7-8-14/h9-10H,4-8H2,1-3H3/p+1/t10-/m0/s1