(3R,5R)-3,5-dimethyl-1-[2-(4-nitrophenoxy)ethyl]piperidin-1-ium

Systemtic Name: (3R,5R)-3,5-dimethyl-1-[2-(4-nitrophenoxy)ethyl]piperidin-1-ium Openeye Name: (3R,5R)-3,5-dimethyl-1-[2-(4-nitrophenoxy)ethyl]piperidin-1-ium CAS Name: (3R,5R)-3,5-dimethyl-1-[2-(4-nitrophenoxy)ethyl]piperidin-1-ium IUPAC Name: (3R,5R)-3,5-dimethyl-1-[2-(4-nitrophenoxy)ethyl]piperidin-1-ium Traditional Name: (3R,5R)-3,5-dimethyl-1-[2-(4-nitrophenoxy)ethyl]piperidin-1-ium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCOC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c1-12-9-13(2)11-16(10-12)7-8-20-15-5-3-14(4-6-15)17(18)19/h3-6,12-13H,7-11H2,1-2H3/p+1/t12-,13-/m1/s1