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

Systemtic Name: 1-[[3-[4-(aminomethyl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[3-[4-(aminomethyl)phenyl]-2-oxo-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[3-[4-(aminomethyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[3-[4-(aminomethyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[3-[4-(aminomethyl)phenyl]-2-keto-oxazolidin-5-yl]methyl]isonipecotic acid Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2CN(C(=O)O2)C3=CC=C(C=C3)CN

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2CN(C(=O)O2)C3=CC=C(C=C3)CN

InChI

InChI=1S/C17H23N3O4/c18-9-12-1-3-14(4-2-12)20-11-15(24-17(20)23)10-19-7-5-13(6-8-19)16(21)22/h1-4,13,15H,5-11,18H2,(H,21,22)