methyl 4-[[5-[(4-butylphenyl)sulfamoyl]-2-methyl-phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[5-[(4-butylphenyl)sulfamoyl]-2-methyl-phenyl]carbonylamino]butanoate Openeye Name: methyl 4-[[5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoyl]amino]butanoate CAS Name: 4-[[[5-[(4-butylphenyl)sulfamoyl]-2-methylphenyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[5-[(4-butylphenyl)sulfamoyl]-2-methylbenzoyl]amino]butanoate Traditional Name: 4-[[5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoyl]amino]butyric acid methyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NCCCC(=O)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NCCCC(=O)OC

InChI

InChI=1S/C23H30N2O5S/c1-4-5-7-18-10-12-19(13-11-18)25-31(28,29)20-14-9-17(2)21(16-20)23(27)24-15-6-8-22(26)30-3/h9-14,16,25H,4-8,15H2,1-3H3,(H,24,27)