ethyl 5-pyridin-3-ylcarbonyl-1-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 5-pyridin-3-ylcarbonyl-1-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 5-(pyridine-3-carbonyl)-1-(2-pyridylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 5-[oxo(3-pyridinyl)methyl]-1-(2-pyridinylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(pyridine-3-carbonyl)-1-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 5-nicotinoyl-1-(2-pyridylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)C3=CN=CC=C3)CC4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)C3=CN=CC=C3)CC4=CC=CC=N4

InChI

InChI=1S/C21H21N5O3/c1-2-29-21(28)19-17-14-25(20(27)15-6-5-9-22-12-15)11-8-18(17)26(24-19)13-16-7-3-4-10-23-16/h3-7,9-10,12H,2,8,11,13-14H2,1H3