3-[4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methoxy]phenyl]-2-[(phenylmethyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methoxy]phenyl]-2-[(phenylmethyl)sulfonylamino]propanoic acid Openeye Name: 2-(benzylsulfonylamino)-3-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidin-5-yl]methoxy]phenyl]propanoic acid CAS Name: 3-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]methoxy]phenyl]-2-[(phenylmethyl)sulfonylamino]propanoic acid IUPAC Name: 2-(benzylsulfonylamino)-3-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Traditional Name: 3-[4-[[3-(4-amidinophenyl)-2-keto-oxazolidin-5-yl]methoxy]phenyl]-2-(benzylsulfonylamino)propionic acid Formula: C27H28N4O7S MolecularWeight: 552.59882

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)N1C2=CC=C(C=C2)C(=N)N)COC3=CC=C(C=C3)CC(C(=O)O)NS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1C(OC(=O)N1C2=CC=C(C=C2)C(=N)N)COC3=CC=C(C=C3)CC(C(=O)O)NS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O7S/c28-25(29)20-8-10-21(11-9-20)31-15-23(38-27(31)34)16-37-22-12-6-18(7-13-22)14-24(26(32)33)30-39(35,36)17-19-4-2-1-3-5-19/h1-13,23-24,30H,14-17H2,(H3,28,29)(H,32,33)