3-[[2-carboxylato-4-methoxy-5-(2-methoxyethoxy)phenyl]sulfamoyl]-4,5-dimethyl-benzoate

Systemtic Name: 3-[[2-carboxylato-4-methoxy-5-(2-methoxyethoxy)phenyl]sulfamoyl]-4,5-dimethyl-benzoate Openeye Name: 3-[[2-carboxylato-4-methoxy-5-(2-methoxyethoxy)phenyl]sulfamoyl]-4,5-dimethyl-benzoate CAS Name: 3-[[2-carboxylato-4-methoxy-5-(2-methoxyethoxy)phenyl]sulfamoyl]-4,5-dimethylbenzoate IUPAC Name: 3-[[2-carboxylato-4-methoxy-5-(2-methoxyethoxy)phenyl]sulfamoyl]-4,5-dimethylbenzoate Traditional Name: 3-[[2-carboxylato-4-methoxy-5-(2-methoxyethoxy)phenyl]sulfamoyl]-4,5-dimethyl-benzoate Formula: C20H21NO9S-2 MolecularWeight: 451.44704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2C(=O)[O-])OC)OCCOC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2C(=O)[O-])OC)OCCOC)C

InChI

InChI=1S/C20H23NO9S/c1-11-7-13(19(22)23)8-18(12(11)2)31(26,27)21-15-10-17(30-6-5-28-3)16(29-4)9-14(15)20(24)25/h7-10,21H,5-6H2,1-4H3,(H,22,23)(H,24,25)/p-2