4-imidazol-1-yl-3-nitro-N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]benzamide

Systemtic Name: 4-imidazol-1-yl-3-nitro-N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]benzamide Openeye Name: 4-imidazol-1-yl-3-nitro-N-[[4-(tetrahydrofuran-2-ylmethoxy)phenyl]methyl]benzamide CAS Name: 4-(1-imidazolyl)-3-nitro-N-[[4-(2-oxolanylmethoxy)phenyl]methyl]benzamide IUPAC Name: 4-imidazol-1-yl-3-nitro-N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]benzamide Traditional Name: 4-imidazol-1-yl-3-nitro-N-[4-(tetrahydrofurfuryloxy)benzyl]benzamide Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)CNC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)COC2=CC=C(C=C2)CNC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5/c27-22(17-5-8-20(21(12-17)26(28)29)25-10-9-23-15-25)24-13-16-3-6-18(7-4-16)31-14-19-2-1-11-30-19/h3-10,12,15,19H,1-2,11,13-14H2,(H,24,27)