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

Systemtic Name: 1-[4-(aminomethyl)phenyl]-2-(1,3-oxazolidin-5-ylcarbonyl)-3-oxidanylidene-piperidine-4-carboxylic acid Openeye Name: 1-[4-(aminomethyl)phenyl]-2-(oxazolidine-5-carbonyl)-3-oxo-piperidine-4-carboxylic acid CAS Name: 1-[4-(aminomethyl)phenyl]-2-[5-oxazolidinyl(oxo)methyl]-3-oxo-4-piperidinecarboxylic acid IUPAC Name: 1-[4-(aminomethyl)phenyl]-2-(1,3-oxazolidine-5-carbonyl)-3-oxopiperidine-4-carboxylic acid Traditional Name: 1-[4-(aminomethyl)phenyl]-3-keto-2-(oxazolidine-5-carbonyl)isonipecotic acid Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)C1C(=O)O)C(=O)C2CNCO2)C3=CC=C(C=C3)CN

Isomeric SMILES

C1CN(C(C(=O)C1C(=O)O)C(=O)C2CNCO2)C3=CC=C(C=C3)CN

InChI

InChI=1S/C17H21N3O5/c18-7-10-1-3-11(4-2-10)20-6-5-12(17(23)24)15(21)14(20)16(22)13-8-19-9-25-13/h1-4,12-14,19H,5-9,18H2,(H,23,24)