[2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] 3-(1-phenylethylsulfamoyl)benzoate

Systemtic Name: [2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] 3-(1-phenylethylsulfamoyl)benzoate Openeye Name: [2-[4-(butanoylamino)phenyl]-2-oxo-ethyl] 3-(1-phenylethylsulfamoyl)benzoate CAS Name: 3-(1-phenylethylsulfamoyl)benzoic acid [2-oxo-2-[4-(1-oxobutylamino)phenyl]ethyl] ester IUPAC Name: [2-[4-(butanoylamino)phenyl]-2-oxoethyl] 3-(1-phenylethylsulfamoyl)benzoate Traditional Name: 3-(1-phenylethylsulfamoyl)benzoic acid [2-(4-butyramidophenyl)-2-keto-ethyl] ester Formula: C27H28N2O6S MolecularWeight: 508.58602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C27H28N2O6S/c1-3-8-26(31)28-23-15-13-21(14-16-23)25(30)18-35-27(32)22-11-7-12-24(17-22)36(33,34)29-19(2)20-9-5-4-6-10-20/h4-7,9-17,19,29H,3,8,18H2,1-2H3,(H,28,31)