4-nitro-N-(oxolan-2-ylmethyl)-3-(1-propan-2-ylpyrazol-4-yl)benzamide

Systemtic Name: 4-nitro-N-(oxolan-2-ylmethyl)-3-(1-propan-2-ylpyrazol-4-yl)benzamide Openeye Name: 3-(1-isopropylpyrazol-4-yl)-4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-nitro-N-(2-oxolanylmethyl)-3-(1-propan-2-yl-4-pyrazolyl)benzamide IUPAC Name: 4-nitro-N-(oxolan-2-ylmethyl)-3-(1-propan-2-ylpyrazol-4-yl)benzamide Traditional Name: 3-(1-isopropylpyrazol-4-yl)-4-nitro-N-(tetrahydrofurfuryl)benzamide Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=N1)C2=C(C=CC(=C2)C(=O)NCC3CCCO3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=C(C=N1)C2=C(C=CC(=C2)C(=O)NCC3CCCO3)[N+](=O)[O-]

InChI

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