(2R)-1-[(6-azanyl-4H-1,3-benzodioxin-8-yl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-[(6-azanyl-4H-1,3-benzodioxin-8-yl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-[(6-amino-4H-1,3-benzodioxin-8-yl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-[(6-amino-4H-1,3-benzodioxin-8-yl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-[(6-amino-4H-1,3-benzodioxin-8-yl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-[(6-amino-4H-1,3-benzodioxin-8-yl)methyl]pyrrolidin-1-ium-2-carboxamide Formula: C14H20N3O3+ MolecularWeight: 278.3269

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=C3C(=CC(=C2)N)COCO3)C(=O)N

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=C3C(=CC(=C2)N)COCO3)C(=O)N

InChI

InChI=1S/C14H19N3O3/c15-11-4-9(13-10(5-11)7-19-8-20-13)6-17-3-1-2-12(17)14(16)18/h4-5,12H,1-3,6-8,15H2,(H2,16,18)/p+1/t12-/m1/s1