methyl 2-[(5-ethoxy-4-methoxy-2-nitro-phenyl)carbonylamino]-5-morpholin-4-yl-benzoate

Systemtic Name: methyl 2-[(5-ethoxy-4-methoxy-2-nitro-phenyl)carbonylamino]-5-morpholin-4-yl-benzoate Openeye Name: methyl 2-[(5-ethoxy-4-methoxy-2-nitro-benzoyl)amino]-5-morpholino-benzoate CAS Name: 2-[[(5-ethoxy-4-methoxy-2-nitrophenyl)-oxomethyl]amino]-5-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 2-[(5-ethoxy-4-methoxy-2-nitrobenzoyl)amino]-5-morpholin-4-ylbenzoate Traditional Name: 2-[(5-ethoxy-4-methoxy-2-nitro-benzoyl)amino]-5-morpholino-benzoic acid methyl ester Formula: C22H25N3O8 MolecularWeight: 459.4492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NC2=C(C=C(C=C2)N3CCOCC3)C(=O)OC)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NC2=C(C=C(C=C2)N3CCOCC3)C(=O)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C22H25N3O8/c1-4-33-20-12-16(18(25(28)29)13-19(20)30-2)21(26)23-17-6-5-14(11-15(17)22(27)31-3)24-7-9-32-10-8-24/h5-6,11-13H,4,7-10H2,1-3H3,(H,23,26)