methyl 2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(4-morpholino-3-nitro-benzoyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(4-morpholino-3-nitro-benzoyl)amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C23H21N3O6S MolecularWeight: 467.49434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O6S/c1-31-23(28)20-17(15-5-3-2-4-6-15)14-33-22(20)24-21(27)16-7-8-18(19(13-16)26(29)30)25-9-11-32-12-10-25/h2-8,13-14H,9-12H2,1H3,(H,24,27)