4-oxidanylidene-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropylsulfonylamino)pentanoic acid

Systemtic Name: 4-oxidanylidene-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropylsulfonylamino)pentanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-4-oxo-5-(3-phenylpropylsulfonylamino)pentanoic acid CAS Name: 4-oxo-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropylsulfonylamino)pentanoic acid IUPAC Name: 4-oxo-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropylsulfonylamino)pentanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-4-keto-5-(3-phenylpropylsulfonylamino)valeric acid Formula: C22H26N2O7S MolecularWeight: 462.51604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCS(=O)(=O)NCC(=O)C(CC(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCS(=O)(=O)NCC(=O)C(CC(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O7S/c25-20(15-23-32(29,30)13-7-12-17-8-3-1-4-9-17)19(14-21(26)27)24-22(28)31-16-18-10-5-2-6-11-18/h1-6,8-11,19,23H,7,12-16H2,(H,24,28)(H,26,27)