3-[4-[4-(5-methyl-1H-imidazol-4-yl)piperidin-1-yl]pyrimidin-5-yl]benzoic acid

Systemtic Name: 3-[4-[4-(5-methyl-1H-imidazol-4-yl)piperidin-1-yl]pyrimidin-5-yl]benzoic acid Openeye Name: 3-[4-[4-(5-methyl-1H-imidazol-4-yl)-1-piperidyl]pyrimidin-5-yl]benzoic acid CAS Name: 3-[4-[4-(5-methyl-1H-imidazol-4-yl)-1-piperidinyl]-5-pyrimidinyl]benzoic acid IUPAC Name: 3-[4-[4-(5-methyl-1H-imidazol-4-yl)piperidin-1-yl]pyrimidin-5-yl]benzoic acid Traditional Name: 3-[4-[4-(5-methyl-1H-imidazol-4-yl)piperidino]pyrimidin-5-yl]benzoic acid Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)C2CCN(CC2)C3=NC=NC=C3C4=CC(=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(N=CN1)C2CCN(CC2)C3=NC=NC=C3C4=CC(=CC=C4)C(=O)O

InChI

InChI=1S/C20H21N5O2/c1-13-18(23-12-22-13)14-5-7-25(8-6-14)19-17(10-21-11-24-19)15-3-2-4-16(9-15)20(26)27/h2-4,9-12,14H,5-8H2,1H3,(H,22,23)(H,26,27)