dimethyl 5-[[(S)-cyclopropyl(phenyl)methyl]sulfamoyl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(S)-cyclopropyl(phenyl)methyl]sulfamoyl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(S)-cyclopropyl(phenyl)methyl]sulfamoyl]benzene-1,3-dicarboxylate CAS Name: 5-[[(S)-cyclopropyl(phenyl)methyl]sulfamoyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(S)-cyclopropyl(phenyl)methyl]sulfamoyl]benzene-1,3-dicarboxylate Traditional Name: 5-[[(S)-cyclopropyl(phenyl)methyl]sulfamoyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NC(C2CC2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)N[C@@H](C2CC2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H21NO6S/c1-26-19(22)15-10-16(20(23)27-2)12-17(11-15)28(24,25)21-18(14-8-9-14)13-6-4-3-5-7-13/h3-7,10-12,14,18,21H,8-9H2,1-2H3/t18-/m1/s1