4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(2-furylmethylamino)-2-oxo-ethyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[2-(2-furanylmethylamino)-2-oxoethyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(2-furfurylamino)-2-keto-ethyl]benzamide Formula: C20H21N5O5 MolecularWeight: 411.41124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5/c1-13-19(25(28)29)14(2)24(23-13)12-15-5-7-16(8-6-15)20(27)22-11-18(26)21-10-17-4-3-9-30-17/h3-9H,10-12H2,1-2H3,(H,21,26)(H,22,27)