N-methyl-N-[2-(1-methylaziridin-1-ium-1-yl)ethyl]-4-nitro-aniline

Systemtic Name: N-methyl-N-[2-(1-methylaziridin-1-ium-1-yl)ethyl]-4-nitro-aniline Openeye Name: N-methyl-N-[2-(1-methylaziridin-1-ium-1-yl)ethyl]-4-nitro-aniline CAS Name: N-methyl-N-[2-(1-methyl-1-aziridin-1-iumyl)ethyl]-4-nitroaniline IUPAC Name: N-methyl-N-[2-(1-methylaziridin-1-ium-1-yl)ethyl]-4-nitroaniline Traditional Name: methyl-[2-(1-methylethylenimin-1-ium-1-yl)ethyl]-(4-nitrophenyl)amine Formula: C12H18N3O2+ MolecularWeight: 236.29022

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[N+]1(CC1)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CC[N+]1(CC1)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H18N3O2/c1-13(7-8-15(2)9-10-15)11-3-5-12(6-4-11)14(16)17/h3-6H,7-10H2,1-2H3/q+1