1-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-4-(carboxymethyl)piperidine-4-carboxylic acid

Systemtic Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-4-(carboxymethyl)piperidine-4-carboxylic acid Openeye Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidin-5-yl]methyl]-4-(carboxymethyl)piperidine-4-carboxylic acid CAS Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]methyl]-4-(carboxymethyl)-4-piperidinecarboxylic acid IUPAC Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-(carboxymethyl)piperidine-4-carboxylic acid Traditional Name: 1-[[3-(4-amidinophenyl)-2-keto-oxazolidin-5-yl]methyl]-4-(carboxymethyl)isonipecotic acid Formula: C19H24N4O6 MolecularWeight: 404.41706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC(=O)O)C(=O)O)CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1(CC(=O)O)C(=O)O)CC2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H24N4O6/c20-16(21)12-1-3-13(4-2-12)23-11-14(29-18(23)28)10-22-7-5-19(6-8-22,17(26)27)9-15(24)25/h1-4,14H,5-11H2,(H3,20,21)(H,24,25)(H,26,27)