N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[4-(1,1-dimethylpropyl)cyclohexyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(4-tert-amylcyclohexyl)-2-morpholino-5-nitro-benzamide Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C22H33N3O4/c1-4-22(2,3)16-5-7-17(8-6-16)23-21(26)19-15-18(25(27)28)9-10-20(19)24-11-13-29-14-12-24/h9-10,15-17H,4-8,11-14H2,1-3H3,(H,23,26)