methyl 2-morpholin-4-yl-5-[2-(4-nitrophenoxy)ethanoylamino]benzoate

Systemtic Name: methyl 2-morpholin-4-yl-5-[2-(4-nitrophenoxy)ethanoylamino]benzoate Openeye Name: methyl 2-morpholino-5-[[2-(4-nitrophenoxy)acetyl]amino]benzoate CAS Name: 2-(4-morpholinyl)-5-[[2-(4-nitrophenoxy)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-morpholin-4-yl-5-[[2-(4-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 2-morpholino-5-[[2-(4-nitrophenoxy)acetyl]amino]benzoic acid methyl ester Formula: C20H21N3O7 MolecularWeight: 415.39664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C20H21N3O7/c1-28-20(25)17-12-14(2-7-18(17)22-8-10-29-11-9-22)21-19(24)13-30-16-5-3-15(4-6-16)23(26)27/h2-7,12H,8-11,13H2,1H3,(H,21,24)