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

Systemtic Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-4-oxidanyl-piperidine-4-carboxylic acid Openeye Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidin-5-yl]methyl]-4-hydroxy-piperidine-4-carboxylic acid CAS Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]methyl]-4-hydroxy-4-piperidinecarboxylic acid IUPAC Name: 1-[[3-(4-carbamimidoylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-hydroxypiperidine-4-carboxylic acid Traditional Name: 1-[[3-(4-amidinophenyl)-2-keto-oxazolidin-5-yl]methyl]-4-hydroxy-isonipecotic acid Formula: C17H22N4O5 MolecularWeight: 362.38038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O5/c18-14(19)11-1-3-12(4-2-11)21-10-13(26-16(21)24)9-20-7-5-17(25,6-8-20)15(22)23/h1-4,13,25H,5-10H2,(H3,18,19)(H,22,23)