N-[(3,4-dimethoxyphenyl)methyl]-5-morpholin-4-yl-2-nitro-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-5-morpholin-4-yl-2-nitro-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-5-morpholino-2-nitro-benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-5-(4-morpholinyl)-2-nitrobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-5-morpholin-4-yl-2-nitrobenzamide Traditional Name: 5-morpholino-2-nitro-N-veratryl-benzamide Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23N3O6/c1-27-18-6-3-14(11-19(18)28-2)13-21-20(24)16-12-15(4-5-17(16)23(25)26)22-7-9-29-10-8-22/h3-6,11-12H,7-10,13H2,1-2H3,(H,21,24)