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

Systemtic Name: methyl 4-[[[4-chloranyl-3-(cyclopropylsulfamoyl)phenyl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[4-chloro-3-(cyclopropylsulfamoyl)benzoyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[4-chloro-3-(cyclopropylsulfamoyl)phenyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-chloro-3-(cyclopropylsulfamoyl)benzoyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[4-chloro-3-(cyclopropylsulfamoyl)benzoyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC3CC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC3CC3

InChI

InChI=1S/C20H21ClN2O5S/c1-23(12-13-3-5-14(6-4-13)20(25)28-2)19(24)15-7-10-17(21)18(11-15)29(26,27)22-16-8-9-16/h3-7,10-11,16,22H,8-9,12H2,1-2H3