2-[4-(dimethylamino)-3-nitro-phenyl]carbonyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]benzamide

Systemtic Name: 2-[4-(dimethylamino)-3-nitro-phenyl]carbonyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]benzamide Openeye Name: 2-[4-(dimethylamino)-3-nitro-benzoyl]-N-[(6-morpholino-3-pyridyl)methyl]benzamide CAS Name: 2-[[4-(dimethylamino)-3-nitrophenyl]-oxomethyl]-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]benzamide IUPAC Name: 2-[4-(dimethylamino)-3-nitrobenzoyl]-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]benzamide Traditional Name: 2-[4-(dimethylamino)-3-nitro-benzoyl]-N-[(6-morpholino-3-pyridyl)methyl]benzamide Formula: C26H27N5O5 MolecularWeight: 489.52308

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCC3=CN=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCC3=CN=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C26H27N5O5/c1-29(2)22-9-8-19(15-23(22)31(34)35)25(32)20-5-3-4-6-21(20)26(33)28-17-18-7-10-24(27-16-18)30-11-13-36-14-12-30/h3-10,15-16H,11-14,17H2,1-2H3,(H,28,33)