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

Systemtic Name: (2S)-2-chloranyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Openeye Name: (2S)-2-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one CAS Name: (2S)-2-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-1-propanone IUPAC Name: (2S)-2-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Traditional Name: (2S)-2-chloro-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Formula: C9H18ClN2O+ MolecularWeight: 205.70502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17ClN2O/c1-8(10)9(13)12-5-3-4-11(2)6-7-12/h8H,3-7H2,1-2H3/p+1/t8-/m0/s1