N-(5-tert-butyl-2-methoxy-phenyl)-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-morpholino-5-nitro-benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-morpholino-5-nitro-benzamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C22H27N3O5/c1-22(2,3)15-5-8-20(29-4)18(13-15)23-21(26)17-14-16(25(27)28)6-7-19(17)24-9-11-30-12-10-24/h5-8,13-14H,9-12H2,1-4H3,(H,23,26)