1-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)piperidine-4-carboxylic acid Openeye Name: 1-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)piperidine-4-carboxylic acid CAS Name: 1-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)piperidine-4-carboxylic acid Traditional Name: 1-(4-keto-6-phenyl-1H-pyrimidin-2-yl)isonipecotic acid Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C16H17N3O3/c20-14-10-13(11-4-2-1-3-5-11)17-16(18-14)19-8-6-12(7-9-19)15(21)22/h1-5,10,12H,6-9H2,(H,21,22)(H,17,18,20)