N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-morpholino-5-nitro-benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-morpholino-5-nitro-benzamide Formula: C19H20ClN3O6 MolecularWeight: 421.8316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)OC)Cl

InChI

InChI=1S/C19H20ClN3O6/c1-27-17-11-15(18(28-2)10-14(17)20)21-19(24)13-9-12(23(25)26)3-4-16(13)22-5-7-29-8-6-22/h3-4,9-11H,5-8H2,1-2H3,(H,21,24)