methyl 4-[[[4-chloranyl-3-(diethylsulfamoyl)phenyl]carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[4-chloranyl-3-(diethylsulfamoyl)phenyl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[4-chloro-3-(diethylsulfamoyl)benzoyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[4-chloro-3-(diethylsulfamoyl)phenyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-chloro-3-(diethylsulfamoyl)benzoyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[4-chloro-3-(diethylsulfamoyl)benzoyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N(C)CC2=CC=C(C=C2)C(=O)OC)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N(C)CC2=CC=C(C=C2)C(=O)OC)Cl

InChI

InChI=1S/C21H25ClN2O5S/c1-5-24(6-2)30(27,28)19-13-17(11-12-18(19)22)20(25)23(3)14-15-7-9-16(10-8-15)21(26)29-4/h7-13H,5-6,14H2,1-4H3