methyl 3-[(2-ethoxy-5-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]-4-methyl-benzoate

Systemtic Name: methyl 3-[(2-ethoxy-5-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]-4-methyl-benzoate Openeye Name: methyl 3-[(2-ethoxy-5-morpholinosulfonyl-phenyl)sulfamoyl]-4-methyl-benzoate CAS Name: 3-[[2-ethoxy-5-(4-morpholinylsulfonyl)phenyl]sulfamoyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)sulfamoyl]-4-methylbenzoate Traditional Name: 3-[(2-ethoxy-5-morpholinosulfonyl-phenyl)sulfamoyl]-4-methyl-benzoic acid methyl ester Formula: C21H26N2O8S2 MolecularWeight: 498.56974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC)C

InChI

InChI=1S/C21H26N2O8S2/c1-4-31-19-8-7-17(33(27,28)23-9-11-30-12-10-23)14-18(19)22-32(25,26)20-13-16(21(24)29-3)6-5-15(20)2/h5-8,13-14,22H,4,9-12H2,1-3H3