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

Systemtic Name: 2-azanyl-3-[4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidin-5-yl]methoxy]phenyl]propanoic acid CAS Name: 2-amino-3-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]methoxy]phenyl]propanoic acid IUPAC Name: 2-amino-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-amino-propionic acid Formula: C20H22N4O5 MolecularWeight: 398.41248

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O5/c21-17(19(25)26)9-12-1-7-15(8-2-12)28-11-16-10-24(20(27)29-16)14-5-3-13(4-6-14)18(22)23/h1-8,16-17H,9-11,21H2,(H3,22,23)(H,25,26)