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

Systemtic Name: N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]-3-nitro-pyridin-2-amine Openeye Name: N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]-3-nitro-pyridin-2-amine CAS Name: N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]-3-nitro-2-pyridinamine IUPAC Name: N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]-3-nitropyridin-2-amine Traditional Name: [2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]-(3-nitro-2-pyridyl)amine Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=CC=N1)[N+](=O)[O-])[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(CNC1=C(C=CC=N1)[N+](=O)[O-])[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H22N4O2/c1-18(2,13-20-17-16(22(23)24)8-5-10-19-17)21-11-9-14-6-3-4-7-15(14)12-21/h3-8,10H,9,11-13H2,1-2H3,(H,19,20)/p+1