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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(tetrahydrofurfuryl)benzamide Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC3CCCO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC3CCCO3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4/c1-12-17(22(24)25)13(2)21(20-12)11-14-5-7-15(8-6-14)18(23)19-10-16-4-3-9-26-16/h5-8,16H,3-4,9-11H2,1-2H3,(H,19,23)