dimethyl-[2-[[5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazol-3-yl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazol-3-yl]carbonylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[[5-(1-methyl-2-pyrrolyl)-2-(3-nitrophenyl)-3-pyrazolyl]-oxomethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]amino]ethyl]azanium Traditional Name: dimethyl-[2-[[5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]amino]ethyl]ammonium Formula: C19H23N6O3+ MolecularWeight: 383.42432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCC[NH+](C)C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCC[NH+](C)C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O3/c1-22(2)11-9-20-19(26)18-13-16(17-8-5-10-23(17)3)21-24(18)14-6-4-7-15(12-14)25(27)28/h4-8,10,12-13H,9,11H2,1-3H3,(H,20,26)/p+1