5-nitro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]pyridin-2-amine

Systemtic Name: 5-nitro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]pyridin-2-amine Openeye Name: 5-nitro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]pyridin-2-amine CAS Name: 5-nitro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]-2-pyridinamine IUPAC Name: 5-nitro-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]pyridin-2-amine Traditional Name: (5-nitro-2-pyridyl)-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]amine Formula: C17H21N4O2+ MolecularWeight: 313.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC=C(C=C1)[N+](=O)[O-])[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

C[C@H](CNC1=NC=C(C=C1)[N+](=O)[O-])[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H20N4O2/c1-13(10-18-17-7-6-16(11-19-17)21(22)23)20-9-8-14-4-2-3-5-15(14)12-20/h2-7,11,13H,8-10,12H2,1H3,(H,18,19)/p+1/t13-/m1/s1