4-[4-(4-chlorophenyl)-3-methoxy-5-pyridin-4-yl-pyrazol-1-yl]piperidine-1-carboxylic acid

Systemtic Name: 4-[4-(4-chlorophenyl)-3-methoxy-5-pyridin-4-yl-pyrazol-1-yl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(4-chlorophenyl)-3-methoxy-5-(4-pyridyl)pyrazol-1-yl]piperidine-1-carboxylic acid CAS Name: 4-[4-(4-chlorophenyl)-3-methoxy-5-pyridin-4-yl-1-pyrazolyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[4-(4-chlorophenyl)-3-methoxy-5-pyridin-4-ylpyrazol-1-yl]piperidine-1-carboxylic acid Traditional Name: 4-[4-(4-chlorophenyl)-3-methoxy-5-(4-pyridyl)pyrazol-1-yl]piperidine-1-carboxylic acid Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C(=C1C2=CC=C(C=C2)Cl)C3=CC=NC=C3)C4CCN(CC4)C(=O)O

Isomeric SMILES

COC1=NN(C(=C1C2=CC=C(C=C2)Cl)C3=CC=NC=C3)C4CCN(CC4)C(=O)O

InChI

InChI=1S/C21H21ClN4O3/c1-29-20-18(14-2-4-16(22)5-3-14)19(15-6-10-23-11-7-15)26(24-20)17-8-12-25(13-9-17)21(27)28/h2-7,10-11,17H,8-9,12-13H2,1H3,(H,27,28)