[3-[(4-methylphenyl)carbonylamino]phenyl] 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [3-[(4-methylphenyl)carbonylamino]phenyl] 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [3-[(4-methylbenzoyl)amino]phenyl] 2-chloro-5-morpholinosulfonyl-benzoate CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)benzoic acid [3-[[(4-methylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [3-[(4-methylbenzoyl)amino]phenyl] 2-chloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-chloro-5-morpholinosulfonyl-benzoic acid [3-(p-toluoylamino)phenyl] ester Formula: C25H23ClN2O6S MolecularWeight: 514.97792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)OC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)OC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C25H23ClN2O6S/c1-17-5-7-18(8-6-17)24(29)27-19-3-2-4-20(15-19)34-25(30)22-16-21(9-10-23(22)26)35(31,32)28-11-13-33-14-12-28/h2-10,15-16H,11-14H2,1H3,(H,27,29)