4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-yl-pyrazol-3-yl]piperazine-1-carboxylate

Systemtic Name: 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-yl-pyrazol-3-yl]piperazine-1-carboxylate Openeye Name: 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-(4-pyridyl)pyrazol-3-yl]piperazine-1-carboxylate CAS Name: 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-yl-3-pyrazolyl]-1-piperazinecarboxylate IUPAC Name: 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-ylpyrazol-3-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-(4-pyridyl)pyrazol-3-yl]piperazine-1-carboxylate Formula: C21H21ClN5O3- MolecularWeight: 426.87614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN(C(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl)CCO)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NN(C(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl)CCO)C(=O)[O-]

InChI

InChI=1S/C21H22ClN5O3/c22-17-3-1-16(2-4-17)19-18(15-5-7-23-8-6-15)20(24-27(19)13-14-28)25-9-11-26(12-10-25)21(29)30/h1-8,28H,9-14H2,(H,29,30)/p-1