1-[butoxy-(3-nitrophenyl)methyl]-N,N-dimethyl-pyridin-1-ium-4-amine

Systemtic Name: 1-[butoxy-(3-nitrophenyl)methyl]-N,N-dimethyl-pyridin-1-ium-4-amine Openeye Name: 1-[butoxy-(3-nitrophenyl)methyl]-N,N-dimethyl-pyridin-1-ium-4-amine CAS Name: 1-[butoxy-(3-nitrophenyl)methyl]-N,N-dimethyl-4-pyridin-1-iumamine IUPAC Name: 1-[butoxy-(3-nitrophenyl)methyl]-N,N-dimethylpyridin-1-ium-4-amine Traditional Name: [1-[butoxy-(3-nitrophenyl)methyl]pyridin-1-ium-4-yl]-dimethyl-amine Formula: C18H24N3O3+ MolecularWeight: 330.40146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C1=CC(=CC=C1)[N+](=O)[O-])[N+]2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCCOC(C1=CC(=CC=C1)[N+](=O)[O-])[N+]2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C18H24N3O3/c1-4-5-13-24-18(15-7-6-8-17(14-15)21(22)23)20-11-9-16(10-12-20)19(2)3/h6-12,14,18H,4-5,13H2,1-3H3/q+1