(phenylmethyl) (2S)-3-phenyl-2-[[phenylmethoxycarbonyl-(phenylmethyl)sulfamoyl]amino]propanoate

Systemtic Name: (phenylmethyl) (2S)-3-phenyl-2-[[phenylmethoxycarbonyl-(phenylmethyl)sulfamoyl]amino]propanoate Openeye Name: benzyl (2S)-2-[[benzyl(benzyloxycarbonyl)sulfamoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-3-phenyl-2-[[phenylmethoxycarbonyl-(phenylmethyl)sulfamoyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[benzyl(phenylmethoxycarbonyl)sulfamoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[benzyl(carbobenzoxy)sulfamoyl]amino]-3-phenyl-propionic acid benzyl ester Formula: C31H30N2O6S MolecularWeight: 558.6447

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)NS(=O)(=O)N(CC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCC2=CC=CC=C2)NS(=O)(=O)N(CC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H30N2O6S/c34-30(38-23-27-17-9-3-10-18-27)29(21-25-13-5-1-6-14-25)32-40(36,37)33(22-26-15-7-2-8-16-26)31(35)39-24-28-19-11-4-12-20-28/h1-20,29,32H,21-24H2/t29-/m0/s1