[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propionic acid [2-keto-2-(4-sulfamoylanilino)ethyl] ester Formula: C25H25N3O7S MolecularWeight: 511.5469

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O7S/c26-36(32,33)21-13-11-20(12-14-21)27-23(29)17-34-24(30)22(15-18-7-3-1-4-8-18)28-25(31)35-16-19-9-5-2-6-10-19/h1-14,22H,15-17H2,(H,27,29)(H,28,31)(H2,26,32,33)/t22-/m0/s1