2-morpholin-4-yl-5-nitro-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]benzamide

Systemtic Name: 2-morpholin-4-yl-5-nitro-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]benzamide Openeye Name: N-[[2-(isopropoxymethyl)phenyl]methyl]-2-morpholino-5-nitro-benzamide CAS Name: 2-(4-morpholinyl)-5-nitro-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]benzamide IUPAC Name: 2-morpholin-4-yl-5-nitro-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]benzamide Traditional Name: N-[2-(isopropoxymethyl)benzyl]-2-morpholino-5-nitro-benzamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=CC=CC=C1CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC(C)OCC1=CC=CC=C1CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C22H27N3O5/c1-16(2)30-15-18-6-4-3-5-17(18)14-23-22(26)20-13-19(25(27)28)7-8-21(20)24-9-11-29-12-10-24/h3-8,13,16H,9-12,14-15H2,1-2H3,(H,23,26)