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

Systemtic Name: dimethyl-[2-[[5-(5-methylfuran-2-yl)-2-(3-nitrophenyl)pyrazol-3-yl]carbonylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[5-(5-methyl-2-furyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[[5-(5-methyl-2-furanyl)-2-(3-nitrophenyl)-3-pyrazolyl]-oxomethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[5-(5-methylfuran-2-yl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]amino]ethyl]azanium Traditional Name: dimethyl-[2-[[5-(5-methyl-2-furyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]amino]ethyl]ammonium Formula: C19H22N5O4+ MolecularWeight: 384.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)NCC[NH+](C)C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)NCC[NH+](C)C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O4/c1-13-7-8-18(28-13)16-12-17(19(25)20-9-10-22(2)3)23(21-16)14-5-4-6-15(11-14)24(26)27/h4-8,11-12H,9-10H2,1-3H3,(H,20,25)/p+1