4-methyl-1-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethyl]piperidin-1-ium

Systemtic Name: 4-methyl-1-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethyl]piperidin-1-ium Openeye Name: 4-methyl-1-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethyl]piperidin-1-ium CAS Name: 4-methyl-1-[2-[2-(5-methyl-2-nitrophenoxy)ethoxy]ethyl]piperidin-1-ium IUPAC Name: 4-methyl-1-[2-[2-(5-methyl-2-nitrophenoxy)ethoxy]ethyl]piperidin-1-ium Traditional Name: 4-methyl-1-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethyl]piperidin-1-ium Formula: C17H27N2O4+ MolecularWeight: 323.40728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCOCCOC2=C(C=CC(=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CCOCCOC2=C(C=CC(=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H26N2O4/c1-14-5-7-18(8-6-14)9-10-22-11-12-23-17-13-15(2)3-4-16(17)19(20)21/h3-4,13-14H,5-12H2,1-2H3/p+1