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

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-[(2-methylphenyl)carbonylamino]ethanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 2-[(2-methylbenzoyl)amino]acetate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]acetic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-[(2-methylbenzoyl)amino]acetate Traditional Name: 2-(o-toluoylamino)acetic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H24N2O6S/c1-16-5-2-3-8-19(16)21(25)22-14-20(24)29-15-17-6-4-7-18(13-17)30(26,27)23-9-11-28-12-10-23/h2-8,13H,9-12,14-15H2,1H3,(H,22,25)