N-(2-ethyl-6-methyl-phenyl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-4-morpholino-3-nitro-benzamide CAS Name: N-(2-ethyl-6-methylphenyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-4-morpholino-3-nitro-benzamide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O4/c1-3-15-6-4-5-14(2)19(15)21-20(24)16-7-8-17(18(13-16)23(25)26)22-9-11-27-12-10-22/h4-8,13H,3,9-12H2,1-2H3,(H,21,24)