N-[[1-(dimethylamino)cycloheptyl]methyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-4-morpholino-3-nitro-benzamide Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCCC1)CNC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1(CCCCCC1)CNC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H32N4O4/c1-23(2)21(9-5-3-4-6-10-21)16-22-20(26)17-7-8-18(19(15-17)25(27)28)24-11-13-29-14-12-24/h7-8,15H,3-6,9-14,16H2,1-2H3,(H,22,26)