1-[1,4-dimethyl-2,6-bis(oxidanylidene)-3-phenyl-pyrimidin-5-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1,4-dimethyl-2,6-bis(oxidanylidene)-3-phenyl-pyrimidin-5-yl]piperidine-4-carboxylic acid Openeye Name: 1-(1,4-dimethyl-2,6-dioxo-3-phenyl-pyrimidin-5-yl)piperidine-4-carboxylic acid CAS Name: 1-(1,4-dimethyl-2,6-dioxo-3-phenyl-5-pyrimidinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(1,4-dimethyl-2,6-dioxo-3-phenylpyrimidin-5-yl)piperidine-4-carboxylic acid Traditional Name: 1-(2,6-diketo-1,4-dimethyl-3-phenyl-pyrimidin-5-yl)isonipecotic acid Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)N1C2=CC=CC=C2)C)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N(C(=O)N1C2=CC=CC=C2)C)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C18H21N3O4/c1-12-15(20-10-8-13(9-11-20)17(23)24)16(22)19(2)18(25)21(12)14-6-4-3-5-7-14/h3-7,13H,8-11H2,1-2H3,(H,23,24)