methyl 4-morpholin-4-yl-3-[2-(2-nitrophenoxy)ethanoylamino]benzoate

Systemtic Name: methyl 4-morpholin-4-yl-3-[2-(2-nitrophenoxy)ethanoylamino]benzoate Openeye Name: methyl 4-morpholino-3-[[2-(2-nitrophenoxy)acetyl]amino]benzoate CAS Name: 4-(4-morpholinyl)-3-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-morpholin-4-yl-3-[[2-(2-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 4-morpholino-3-[[2-(2-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=CC(=C(C=C1)N2CCOCC2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

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