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

Systemtic Name: 4-oxidanylidene-5-(phenethylsulfonylamino)-3-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-4-oxo-5-(phenethylsulfonylamino)pentanoic acid CAS Name: 4-oxo-5-(phenethylsulfonylamino)-3-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 4-oxo-5-(phenethylsulfonylamino)-3-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-4-keto-5-(phenethylsulfonylamino)valeric acid Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O7S/c24-19(14-22-31(28,29)12-11-16-7-3-1-4-8-16)18(13-20(25)26)23-21(27)30-15-17-9-5-2-6-10-17/h1-10,18,22H,11-15H2,(H,23,27)(H,25,26)