[4-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl] 3-nitrobenzenesulfonate

Systemtic Name: [4-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl] 3-nitrobenzenesulfonate Openeye Name: [4-[(2-morpholinophenyl)carbamoyl]phenyl] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [4-[[2-(4-morpholinyl)anilino]-oxomethyl]phenyl] ester IUPAC Name: [4-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl] 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [4-[(2-morpholinophenyl)carbamoyl]phenyl] ester Formula: C23H21N3O7S MolecularWeight: 483.49374

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O7S/c27-23(24-21-6-1-2-7-22(21)25-12-14-32-15-13-25)17-8-10-19(11-9-17)33-34(30,31)20-5-3-4-18(16-20)26(28)29/h1-11,16H,12-15H2,(H,24,27)