2-(4-chloranylphenoxy)ethyl-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-methyl-azanium

Systemtic Name: 2-(4-chloranylphenoxy)ethyl-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-methyl-azanium Openeye Name: 2-(4-chlorophenoxy)ethyl-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-methyl-ammonium CAS Name: 2-(4-chlorophenoxy)ethyl-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-methylammonium IUPAC Name: 2-(4-chlorophenoxy)ethyl-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-methylazanium Traditional Name: 2-(4-chlorophenoxy)ethyl-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-methyl-ammonium Formula: C15H20ClN4O3+ MolecularWeight: 339.7973

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C[NH+](C)CCOC2=CC=C(C=C2)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C[NH+](C)CCOC2=CC=C(C=C2)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C15H19ClN4O3/c1-11-15(20(21)22)12(2)19(17-11)10-18(3)8-9-23-14-6-4-13(16)5-7-14/h4-7H,8-10H2,1-3H3/p+1