methyl 4-[[4-(dimethylsulfamoyl)piperazin-1-yl]methyl]-3-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: methyl 4-[[4-(dimethylsulfamoyl)piperazin-1-yl]methyl]-3-oxidanyl-naphthalene-2-carboxylate Openeye Name: methyl 4-[[4-(dimethylsulfamoyl)piperazin-1-yl]methyl]-3-hydroxy-naphthalene-2-carboxylate CAS Name: 4-[[4-(dimethylsulfamoyl)-1-piperazinyl]methyl]-3-hydroxy-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 4-[[4-(dimethylsulfamoyl)piperazin-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylate Traditional Name: 4-[[4-(dimethylsulfamoyl)piperazino]methyl]-3-hydroxy-naphthalene-2-carboxylic acid methyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)CC2=C(C(=CC3=CC=CC=C32)C(=O)OC)O

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)CC2=C(C(=CC3=CC=CC=C32)C(=O)OC)O

InChI

InChI=1S/C19H25N3O5S/c1-20(2)28(25,26)22-10-8-21(9-11-22)13-17-15-7-5-4-6-14(15)12-16(18(17)23)19(24)27-3/h4-7,12,23H,8-11,13H2,1-3H3