[3-[(4-nitrophenyl)carbonylamino]phenyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [3-[(4-nitrophenyl)carbonylamino]phenyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [3-[(4-nitrobenzoyl)amino]phenyl] 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid [3-[[(4-nitrophenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [3-[(4-nitrobenzoyl)amino]phenyl] 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid [3-[(4-nitrobenzoyl)amino]phenyl] ester Formula: C25H23N3O8S MolecularWeight: 525.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H23N3O8S/c1-17-5-6-19(15-23(17)37(33,34)27-11-13-35-14-12-27)25(30)36-22-4-2-3-20(16-22)26-24(29)18-7-9-21(10-8-18)28(31)32/h2-10,15-16H,11-14H2,1H3,(H,26,29)