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

Systemtic Name: 1-[[3-[4-(2-azanyl-2-azanylidene-ethyl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[3-[4-(2-amino-2-imino-ethyl)phenyl]-2-oxo-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[3-[4-(2-amino-2-iminoethyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[3-[4-(2-amino-2-iminoethyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[3-[4-(2-amino-2-imino-ethyl)phenyl]-2-keto-oxazolidin-5-yl]methyl]isonipecotic acid Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O4/c19-16(20)9-12-1-3-14(4-2-12)22-11-15(26-18(22)25)10-21-7-5-13(6-8-21)17(23)24/h1-4,13,15H,5-11H2,(H3,19,20)(H,23,24)