(3-morpholin-4-ylsulfonylphenyl)methyl 2-[(3-methylphenyl)carbonylamino]benzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-[(3-methylphenyl)carbonylamino]benzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 2-[(3-methylbenzoyl)amino]benzoate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]benzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-[(3-methylbenzoyl)amino]benzoate Traditional Name: 2-(m-toluoylamino)benzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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