6-(4-methylphenyl)-2-pyrrolidin-1-yl-pyrimidine-4-carboxylic acid

Systemtic Name: 6-(4-methylphenyl)-2-pyrrolidin-1-yl-pyrimidine-4-carboxylic acid Openeye Name: 6-(p-tolyl)-2-pyrrolidin-1-yl-pyrimidine-4-carboxylic acid CAS Name: 6-(4-methylphenyl)-2-(1-pyrrolidinyl)-4-pyrimidinecarboxylic acid IUPAC Name: 6-(4-methylphenyl)-2-pyrrolidin-1-ylpyrimidine-4-carboxylic acid Traditional Name: 6-(p-tolyl)-2-pyrrolidino-pyrimidine-4-carboxylic acid Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCCC3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCCC3)C(=O)O

InChI

InChI=1S/C16H17N3O2/c1-11-4-6-12(7-5-11)13-10-14(15(20)21)18-16(17-13)19-8-2-3-9-19/h4-7,10H,2-3,8-9H2,1H3,(H,20,21)