2-[4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-1-oxidanidyl-piperazin-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-1-oxidanidyl-piperazin-1-ium-1-yl]ethanoic acid Openeye Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidin-5-yl]methyl]-1-oxido-piperazin-1-ium-1-yl]acetic acid CAS Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]methyl]-1-oxido-1-piperazin-1-iumyl]acetic acid IUPAC Name: 2-[4-[[3-(4-carbamimidoylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-1-oxidopiperazin-1-ium-1-yl]acetic acid Traditional Name: 2-[4-[[3-(4-amidinophenyl)-2-keto-oxazolidin-5-yl]methyl]-1-oxido-piperazin-1-ium-1-yl]acetic acid Formula: C17H23N5O5 MolecularWeight: 377.39502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N)(CC(=O)O)[O-]

Isomeric SMILES

C1C[N+](CCN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N)(CC(=O)O)[O-]

InChI

InChI=1S/C17H23N5O5/c18-16(19)12-1-3-13(4-2-12)21-10-14(27-17(21)25)9-20-5-7-22(26,8-6-20)11-15(23)24/h1-4,14H,5-11H2,(H3,18,19)(H,23,24)