methyl 3-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-4-morpholin-4-yl-benzoate

Systemtic Name: methyl 3-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-4-morpholin-4-yl-benzoate Openeye Name: methyl 3-[(4-ethoxy-3-nitro-benzoyl)amino]-4-morpholino-benzoate CAS Name: 3-[[(4-ethoxy-3-nitrophenyl)-oxomethyl]amino]-4-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(4-ethoxy-3-nitrobenzoyl)amino]-4-morpholin-4-ylbenzoate Traditional Name: 3-[(4-ethoxy-3-nitro-benzoyl)amino]-4-morpholino-benzoic acid methyl ester Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O7/c1-3-31-19-7-5-14(13-18(19)24(27)28)20(25)22-16-12-15(21(26)29-2)4-6-17(16)23-8-10-30-11-9-23/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,25)