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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(furan-2-yl)butan-2-yl]benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[3-(2-furyl)-1-methyl-propyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[4-(2-furanyl)butan-2-yl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[4-(furan-2-yl)butan-2-yl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[3-(2-furyl)-1-methyl-propyl]benzamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC(C)CCC3=CC=CO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC(C)CCC3=CC=CO3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4/c1-14(6-11-19-5-4-12-29-19)22-21(26)18-9-7-17(8-10-18)13-24-16(3)20(25(27)28)15(2)23-24/h4-5,7-10,12,14H,6,11,13H2,1-3H3,(H,22,26)