ethyl 5-chloranyl-3-isoquinolin-1-yl-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-chloranyl-3-isoquinolin-1-yl-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-chloro-3-(1-isoquinolyl)-1H-pyrazole-4-carboxylate CAS Name: 5-chloro-3-(1-isoquinolinyl)-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-isoquinolin-1-yl-1H-pyrazole-4-carboxylate Traditional Name: 5-chloro-3-(1-isoquinolyl)-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C15H12ClN3O2 MolecularWeight: 301.72768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1C2=NC=CC3=CC=CC=C32)Cl

Isomeric SMILES

CCOC(=O)C1=C(NN=C1C2=NC=CC3=CC=CC=C32)Cl

InChI

InChI=1S/C15H12ClN3O2/c1-2-21-15(20)11-13(18-19-14(11)16)12-10-6-4-3-5-9(10)7-8-17-12/h3-8H,2H2,1H3,(H,18,19)