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

Systemtic Name: methyl 5-[(2-methyl-3-nitro-phenyl)carbonylamino]-2-morpholin-4-yl-benzoate Openeye Name: methyl 5-[(2-methyl-3-nitro-benzoyl)amino]-2-morpholino-benzoate CAS Name: 5-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]-2-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 5-[(2-methyl-3-nitrobenzoyl)amino]-2-morpholin-4-ylbenzoate Traditional Name: 5-[(2-methyl-3-nitro-benzoyl)amino]-2-morpholino-benzoic acid methyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC(=C(C=C2)N3CCOCC3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC(=C(C=C2)N3CCOCC3)C(=O)OC

InChI

InChI=1S/C20H21N3O6/c1-13-15(4-3-5-17(13)23(26)27)19(24)21-14-6-7-18(16(12-14)20(25)28-2)22-8-10-29-11-9-22/h3-7,12H,8-11H2,1-2H3,(H,21,24)