2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl-methyl-amino]-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl-methyl-amino]-N-(furan-2-ylmethyl)benzamide Openeye Name: 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-methyl-amino]-N-(2-furylmethyl)benzamide CAS Name: 2-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]-methylamino]-N-(2-furanylmethyl)benzamide IUPAC Name: 2-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]-methylamino]-N-(furan-2-ylmethyl)benzamide Traditional Name: 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-methyl-amino]-N-(2-furfuryl)benzamide Formula: C20H21N5O5 MolecularWeight: 411.41124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5/c1-13-19(25(28)29)14(2)24(22-13)12-18(26)23(3)17-9-5-4-8-16(17)20(27)21-11-15-7-6-10-30-15/h4-10H,11-12H2,1-3H3,(H,21,27)