[1-methoxycarbonyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylidene-dimethyl-azanium

Systemtic Name: [1-methoxycarbonyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylidene-dimethyl-azanium Openeye Name: [1-methoxycarbonyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methylene-dimethyl-ammonium CAS Name: [1-methoxycarbonyl-3-(5-nitro-2-furanyl)-4-pyrazolyl]methylidene-dimethylammonium IUPAC Name: [1-methoxycarbonyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylidene-dimethylazanium Traditional Name: [1-carbomethoxy-3-(5-nitro-2-furyl)pyrazol-4-yl]methylene-dimethyl-ammonium Formula: C12H13N4O5+ MolecularWeight: 293.25542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CC1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

C[N+](=CC1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C12H13N4O5/c1-14(2)6-8-7-15(12(17)20-3)13-11(8)9-4-5-10(21-9)16(18)19/h4-7H,1-3H3/q+1