[2-oxidanylidene-2-(2-phenylbutylamino)ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylbutylamino)ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: [2-oxo-2-(2-phenylbutylamino)ethyl] 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid [2-oxo-2-(2-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylbutylamino)ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid [2-keto-2-(2-phenylbutylamino)ethyl] ester Formula: C25H28N2O5S MolecularWeight: 468.56522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O5S/c1-2-19(20-8-4-3-5-9-20)17-26-24(28)18-32-25(29)14-15-27-33(30,31)23-13-12-21-10-6-7-11-22(21)16-23/h3-13,16,19,27H,2,14-15,17-18H2,1H3,(H,26,28)