methyl 4,5-dimethoxy-2-[(2-morpholin-4-yl-5-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[(2-morpholin-4-yl-5-nitro-phenyl)carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[(2-morpholino-5-nitro-benzoyl)amino]benzoate CAS Name: 4,5-dimethoxy-2-[[[2-(4-morpholinyl)-5-nitrophenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(2-morpholin-4-yl-5-nitrobenzoyl)amino]benzoate Traditional Name: 4,5-dimethoxy-2-[(2-morpholino-5-nitro-benzoyl)amino]benzoic acid methyl ester Formula: C21H23N3O8 MolecularWeight: 445.42262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O8/c1-29-18-11-14(21(26)31-3)16(12-19(18)30-2)22-20(25)15-10-13(24(27)28)4-5-17(15)23-6-8-32-9-7-23/h4-5,10-12H,6-9H2,1-3H3,(H,22,25)