ethyl 4-[[5-(2-azanyl-2-oxidanylidene-ethoxy)-2-chloranyl-4-methyl-phenyl]sulfonylamino]benzoate

Systemtic Name: ethyl 4-[[5-(2-azanyl-2-oxidanylidene-ethoxy)-2-chloranyl-4-methyl-phenyl]sulfonylamino]benzoate Openeye Name: ethyl 4-[[5-(2-amino-2-oxo-ethoxy)-2-chloro-4-methyl-phenyl]sulfonylamino]benzoate CAS Name: 4-[[5-(2-amino-2-oxoethoxy)-2-chloro-4-methylphenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-(2-amino-2-oxoethoxy)-2-chloro-4-methylphenyl]sulfonylamino]benzoate Traditional Name: 4-[[5-(2-amino-2-keto-ethoxy)-2-chloro-4-methyl-phenyl]sulfonylamino]benzoic acid ethyl ester Formula: C18H19ClN2O6S MolecularWeight: 426.87126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=C(C(=C2)OCC(=O)N)C)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=C(C(=C2)OCC(=O)N)C)Cl

InChI

InChI=1S/C18H19ClN2O6S/c1-3-26-18(23)12-4-6-13(7-5-12)21-28(24,25)16-9-15(27-10-17(20)22)11(2)8-14(16)19/h4-9,21H,3,10H2,1-2H3,(H2,20,22)