N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-3-nitro-pyridin-2-amine

Systemtic Name: N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-3-nitro-pyridin-2-amine Openeye Name: N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-3-nitro-pyridin-2-amine CAS Name: N-[[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]methyl]-3-nitro-2-pyridinamine IUPAC Name: N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-3-nitropyridin-2-amine Traditional Name: [4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzyl]-(3-nitro-2-pyridyl)amine Formula: C19H25N4O2+ MolecularWeight: 341.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O2/c1-15-8-11-22(12-9-15)14-17-6-4-16(5-7-17)13-21-19-18(23(24)25)3-2-10-20-19/h2-7,10,15H,8-9,11-14H2,1H3,(H,20,21)/p+1