N-[(2-chlorophenyl)methyl]-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[(2-chlorophenyl)methyl]-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-[(2-chlorophenyl)methyl]-3-nitro-pyridin-1-ium-2-amine CAS Name: N-[(2-chlorophenyl)methyl]-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-[(2-chlorophenyl)methyl]-3-nitropyridin-1-ium-2-amine Traditional Name: (2-chlorobenzyl)-(3-nitropyridin-1-ium-2-yl)amine Formula: C12H11ClN3O2+ MolecularWeight: 264.68764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C=CC=[NH+]2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C=CC=[NH+]2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H10ClN3O2/c13-10-5-2-1-4-9(10)8-15-12-11(16(17)18)6-3-7-14-12/h1-7H,8H2,(H,14,15)/p+1