4-imidazol-1-yl-N-(4-methyl-2-morpholin-4-yl-pentyl)-3-nitro-benzamide

Systemtic Name: 4-imidazol-1-yl-N-(4-methyl-2-morpholin-4-yl-pentyl)-3-nitro-benzamide Openeye Name: 4-imidazol-1-yl-N-(4-methyl-2-morpholino-pentyl)-3-nitro-benzamide CAS Name: 4-(1-imidazolyl)-N-[4-methyl-2-(4-morpholinyl)pentyl]-3-nitrobenzamide IUPAC Name: 4-imidazol-1-yl-N-(4-methyl-2-morpholin-4-ylpentyl)-3-nitrobenzamide Traditional Name: 4-imidazol-1-yl-N-(4-methyl-2-morpholino-pentyl)-3-nitro-benzamide Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)C1=CC(=C(C=C1)N2C=CN=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC(C)CC(CNC(=O)C1=CC(=C(C=C1)N2C=CN=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C20H27N5O4/c1-15(2)11-17(23-7-9-29-10-8-23)13-22-20(26)16-3-4-18(19(12-16)25(27)28)24-6-5-21-14-24/h3-6,12,14-15,17H,7-11,13H2,1-2H3,(H,22,26)