(3R)-3-methyl-1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidin-1-ium

Systemtic Name: (3R)-3-methyl-1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidin-1-ium Openeye Name: (3R)-3-methyl-1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidin-1-ium CAS Name: (3R)-3-methyl-1-[2-(4-methyl-2-nitrophenoxy)ethyl]piperidin-1-ium IUPAC Name: (3R)-3-methyl-1-[2-(4-methyl-2-nitrophenoxy)ethyl]piperidin-1-ium Traditional Name: (3R)-3-methyl-1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidin-1-ium Formula: C15H23N2O3+ MolecularWeight: 279.35472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCOC2=C(C=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CCOC2=C(C=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O3/c1-12-5-6-15(14(10-12)17(18)19)20-9-8-16-7-3-4-13(2)11-16/h5-6,10,13H,3-4,7-9,11H2,1-2H3/p+1/t13-/m1/s1