methyl 7-[[3-[(4-bromophenyl)sulfamoyl]phenyl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[3-[(4-bromophenyl)sulfamoyl]phenyl]carbonylamino]heptanoate Openeye Name: methyl 7-[[3-[(4-bromophenyl)sulfamoyl]benzoyl]amino]heptanoate CAS Name: 7-[[[3-[(4-bromophenyl)sulfamoyl]phenyl]-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[3-[(4-bromophenyl)sulfamoyl]benzoyl]amino]heptanoate Traditional Name: 7-[[3-[(4-bromophenyl)sulfamoyl]benzoyl]amino]enanthic acid methyl ester Formula: C21H25BrN2O5S MolecularWeight: 497.4026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H25BrN2O5S/c1-29-20(25)9-4-2-3-5-14-23-21(26)16-7-6-8-19(15-16)30(27,28)24-18-12-10-17(22)11-13-18/h6-8,10-13,15,24H,2-5,9,14H2,1H3,(H,23,26)