[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate

Systemtic Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl] 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate CAS Name: 3-[(3-chlorophenyl)-methylsulfamoyl]benzoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-[(3-chlorophenyl)-methylsulfamoyl]benzoate Traditional Name: 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl] ester Formula: C25H23ClN2O5S MolecularWeight: 498.97852

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H23ClN2O5S/c1-27(22-10-5-9-21(26)15-22)34(31,32)23-11-4-8-19(14-23)25(30)33-17-24(29)28-13-12-18-6-2-3-7-20(18)16-28/h2-11,14-15H,12-13,16-17H2,1H3