2-[4-(3-methoxyphenyl)-1-pyridin-2-yl-piperidin-4-yl]pyrimidine-5-carboxylic acid

Systemtic Name: 2-[4-(3-methoxyphenyl)-1-pyridin-2-yl-piperidin-4-yl]pyrimidine-5-carboxylic acid Openeye Name: 2-[4-(3-methoxyphenyl)-1-(2-pyridyl)-4-piperidyl]pyrimidine-5-carboxylic acid CAS Name: 2-[4-(3-methoxyphenyl)-1-(2-pyridinyl)-4-piperidinyl]-5-pyrimidinecarboxylic acid IUPAC Name: 2-[4-(3-methoxyphenyl)-1-pyridin-2-ylpiperidin-4-yl]pyrimidine-5-carboxylic acid Traditional Name: 2-[4-(3-methoxyphenyl)-1-(2-pyridyl)-4-piperidyl]pyrimidine-5-carboxylic acid Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCN(CC2)C3=CC=CC=N3)C4=NC=C(C=N4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCN(CC2)C3=CC=CC=N3)C4=NC=C(C=N4)C(=O)O

InChI

InChI=1S/C22H22N4O3/c1-29-18-6-4-5-17(13-18)22(21-24-14-16(15-25-21)20(27)28)8-11-26(12-9-22)19-7-2-3-10-23-19/h2-7,10,13-15H,8-9,11-12H2,1H3,(H,27,28)