3,4,5-trimethoxy-N-(2-methyl-4-morpholin-4-yl-phenyl)-2-nitro-benzamide

Systemtic Name: 3,4,5-trimethoxy-N-(2-methyl-4-morpholin-4-yl-phenyl)-2-nitro-benzamide Openeye Name: 3,4,5-trimethoxy-N-(2-methyl-4-morpholino-phenyl)-2-nitro-benzamide CAS Name: 3,4,5-trimethoxy-N-[2-methyl-4-(4-morpholinyl)phenyl]-2-nitrobenzamide IUPAC Name: 3,4,5-trimethoxy-N-(2-methyl-4-morpholin-4-ylphenyl)-2-nitrobenzamide Traditional Name: 3,4,5-trimethoxy-N-(2-methyl-4-morpholino-phenyl)-2-nitro-benzamide Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCOCC2)NC(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCOCC2)NC(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C21H25N3O7/c1-13-11-14(23-7-9-31-10-8-23)5-6-16(13)22-21(25)15-12-17(28-2)19(29-3)20(30-4)18(15)24(26)27/h5-6,11-12H,7-10H2,1-4H3,(H,22,25)