[(2S)-heptan-2-yl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium

Systemtic Name: [(2S)-heptan-2-yl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium Openeye Name: [(1S)-1-methylhexyl]-(3-oxo-3-pyrrolidin-1-yl-propyl)ammonium CAS Name: [(2S)-heptan-2-yl]-[3-oxo-3-(1-pyrrolidinyl)propyl]ammonium IUPAC Name: [(2S)-heptan-2-yl]-(3-oxo-3-pyrrolidin-1-ylpropyl)azanium Traditional Name: (3-keto-3-pyrrolidino-propyl)-[(1S)-1-methylhexyl]ammonium Formula: C14H29N2O+ MolecularWeight: 241.39286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CCC(=O)N1CCCC1

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CCC(=O)N1CCCC1

InChI

InChI=1S/C14H28N2O/c1-3-4-5-8-13(2)15-10-9-14(17)16-11-6-7-12-16/h13,15H,3-12H2,1-2H3/p+1/t13-/m0/s1