N-(3,4-diethoxyphenyl)-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(3,4-diethoxyphenyl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(3,4-diethoxyphenyl)-2-morpholino-5-nitro-benzamide CAS Name: N-(3,4-diethoxyphenyl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(3,4-diethoxyphenyl)-2-morpholino-5-nitro-benzamide Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)OCC

InChI

InChI=1S/C21H25N3O6/c1-3-29-19-8-5-15(13-20(19)30-4-2)22-21(25)17-14-16(24(26)27)6-7-18(17)23-9-11-28-12-10-23/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,22,25)