(2,6-dimethylphenyl) 2-[(4-chlorophenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: (2,6-dimethylphenyl) 2-[(4-chlorophenyl)-methylsulfonyl-amino]ethanoate Openeye Name: (2,6-dimethylphenyl) 2-(4-chloro-N-methylsulfonyl-anilino)acetate CAS Name: 2-(4-chloro-N-methylsulfonylanilino)acetic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-(4-chloro-N-methylsulfonylanilino)acetate Traditional Name: 2-(4-chloro-N-mesyl-anilino)acetic acid (2,6-dimethylphenyl) ester Formula: C17H18ClNO4S MolecularWeight: 367.84712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C17H18ClNO4S/c1-12-5-4-6-13(2)17(12)23-16(20)11-19(24(3,21)22)15-9-7-14(18)8-10-15/h4-10H,11H2,1-3H3