3-[[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(1S)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(2S)-1-(1-azepanyl)-1-oxopropan-2-yl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(2S)-1-(azepan-1-yl)-1-oxopropan-2-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[(1S)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]amino]propyl-dimethyl-ammonium Formula: C14H30N3O+ MolecularWeight: 256.4075

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)NCCC[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)N1CCCCCC1)NCCC[NH+](C)C

InChI

InChI=1S/C14H29N3O/c1-13(15-9-8-10-16(2)3)14(18)17-11-6-4-5-7-12-17/h13,15H,4-12H2,1-3H3/p+1/t13-/m0/s1