ethyl 4-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]benzoate CAS Name: 4-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxypropanoyl]amino]benzoate Traditional Name: 4-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]benzoic acid ethyl ester Formula: C19H21ClN2O8S2 MolecularWeight: 504.96164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(COS(=O)(=O)C)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(COS(=O)(=O)C)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H21ClN2O8S2/c1-3-29-19(24)13-4-8-15(9-5-13)21-18(23)17(12-30-31(2,25)26)22-32(27,28)16-10-6-14(20)7-11-16/h4-11,17,22H,3,12H2,1-2H3,(H,21,23)