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

Systemtic Name: methyl 4-[[[3-(cyclopropylmethylsulfamoyl)phenyl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[3-(cyclopropylmethylsulfamoyl)benzoyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[3-(cyclopropylmethylsulfamoyl)phenyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[3-(cyclopropylmethylsulfamoyl)benzoyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[3-(cyclopropylmethylsulfamoyl)benzoyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3CC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3CC3

InChI

InChI=1S/C21H24N2O5S/c1-23(14-16-8-10-17(11-9-16)21(25)28-2)20(24)18-4-3-5-19(12-18)29(26,27)22-13-15-6-7-15/h3-5,8-12,15,22H,6-7,13-14H2,1-2H3