(4-morpholin-4-ylsulfonylphenyl)methyl 2-[(4-methylphenyl)carbonylamino]benzoate

Systemtic Name: (4-morpholin-4-ylsulfonylphenyl)methyl 2-[(4-methylphenyl)carbonylamino]benzoate Openeye Name: (4-morpholinosulfonylphenyl)methyl 2-[(4-methylbenzoyl)amino]benzoate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]benzoic acid [4-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (4-morpholin-4-ylsulfonylphenyl)methyl 2-[(4-methylbenzoyl)amino]benzoate Traditional Name: 2-(p-toluoylamino)benzoic acid (4-morpholinosulfonylbenzyl) ester Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C26H26N2O6S/c1-19-6-10-21(11-7-19)25(29)27-24-5-3-2-4-23(24)26(30)34-18-20-8-12-22(13-9-20)35(31,32)28-14-16-33-17-15-28/h2-13H,14-18H2,1H3,(H,27,29)