ethyl 6-phenyl-6-pyrimidin-4-yl-1,7-dihydroindazole-3-carboxylate

Systemtic Name: ethyl 6-phenyl-6-pyrimidin-4-yl-1,7-dihydroindazole-3-carboxylate Openeye Name: ethyl 6-phenyl-6-pyrimidin-4-yl-1,7-dihydroindazole-3-carboxylate CAS Name: 6-phenyl-6-(4-pyrimidinyl)-1,7-dihydroindazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-phenyl-6-pyrimidin-4-yl-1,7-dihydroindazole-3-carboxylate Traditional Name: 6-phenyl-6-(4-pyrimidyl)-1,7-dihydroindazole-3-carboxylic acid ethyl ester Formula: C20H18N4O2 MolecularWeight: 346.38252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC2=C1C=CC(C2)(C3=CC=CC=C3)C4=NC=NC=C4

Isomeric SMILES

CCOC(=O)C1=NNC2=C1C=CC(C2)(C3=CC=CC=C3)C4=NC=NC=C4

InChI

InChI=1S/C20H18N4O2/c1-2-26-19(25)18-15-8-10-20(12-16(15)23-24-18,14-6-4-3-5-7-14)17-9-11-21-13-22-17/h3-11,13H,2,12H2,1H3,(H,23,24)