1-(4-methyl-6-phenyl-pyrimidin-2-yl)piperidine-3-carboxylic acid

Systemtic Name: 1-(4-methyl-6-phenyl-pyrimidin-2-yl)piperidine-3-carboxylic acid Openeye Name: 1-(4-methyl-6-phenyl-pyrimidin-2-yl)piperidine-3-carboxylic acid CAS Name: 1-(4-methyl-6-phenyl-2-pyrimidinyl)-3-piperidinecarboxylic acid IUPAC Name: 1-(4-methyl-6-phenylpyrimidin-2-yl)piperidine-3-carboxylic acid Traditional Name: 1-(4-methyl-6-phenyl-pyrimidin-2-yl)nipecotic acid Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C17H19N3O2/c1-12-10-15(13-6-3-2-4-7-13)19-17(18-12)20-9-5-8-14(11-20)16(21)22/h2-4,6-7,10,14H,5,8-9,11H2,1H3,(H,21,22)