4-tert-butyl-N-(4-morpholin-4-ylphenyl)-3-nitro-benzamide

Systemtic Name: 4-tert-butyl-N-(4-morpholin-4-ylphenyl)-3-nitro-benzamide Openeye Name: 4-tert-butyl-N-(4-morpholinophenyl)-3-nitro-benzamide CAS Name: 4-tert-butyl-N-[4-(4-morpholinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-tert-butyl-N-(4-morpholin-4-ylphenyl)-3-nitrobenzamide Traditional Name: 4-tert-butyl-N-(4-morpholinophenyl)-3-nitro-benzamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-21(2,3)18-9-4-15(14-19(18)24(26)27)20(25)22-16-5-7-17(8-6-16)23-10-12-28-13-11-23/h4-9,14H,10-13H2,1-3H3,(H,22,25)