methyl 4,5-dimethoxy-2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[(4-morpholino-3-nitro-benzoyl)amino]benzoate CAS Name: 4,5-dimethoxy-2-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]benzoate Traditional Name: 4,5-dimethoxy-2-[(4-morpholino-3-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=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])OC

Isomeric SMILES

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

InChI

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