(5S)-1-[bis(azanyl)methylidene]-5-[(2S)-2-oxidanylnonyl]pyrrolidin-1-ium-2-ol

Systemtic Name: (5S)-1-[bis(azanyl)methylidene]-5-[(2S)-2-oxidanylnonyl]pyrrolidin-1-ium-2-ol Openeye Name: (5S)-1-(diaminomethylene)-5-[(2S)-2-hydroxynonyl]pyrrolidin-1-ium-2-ol CAS Name: (5S)-1-(diaminomethylidene)-5-[(2S)-2-hydroxynonyl]-2-pyrrolidin-1-iumol IUPAC Name: (5S)-1-(diaminomethylidene)-5-[(2S)-2-hydroxynonyl]pyrrolidin-1-ium-2-ol Traditional Name: (5S)-1-(diaminomethylene)-5-[(2S)-2-hydroxynonyl]pyrrolidin-1-ium-2-ol Formula: C14H30N3O2+ MolecularWeight: 272.4069

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC1CCC([N+]1=C(N)N)O)O

Isomeric SMILES

CCCCCCC[C@@H](C[C@@H]1CCC([N+]1=C(N)N)O)O

InChI

InChI=1S/C14H29N3O2/c1-2-3-4-5-6-7-12(18)10-11-8-9-13(19)17(11)14(15)16/h11-13,18-19H,2-10H2,1H3,(H3,15,16)/p+1/t11-,12-,13?/m0/s1