4-(3-hept-1-ynyl-4-methyl-phenyl)-1H-pyrazolo[3,4-b]pyridine

Systemtic Name: 4-(3-hept-1-ynyl-4-methyl-phenyl)-1H-pyrazolo[3,4-b]pyridine Openeye Name: 4-(3-hept-1-ynyl-4-methyl-phenyl)-1H-pyrazolo[3,4-b]pyridine CAS Name: 4-(3-hept-1-ynyl-4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine IUPAC Name: 4-(3-hept-1-ynyl-4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine Traditional Name: 4-(3-hept-1-ynyl-4-methyl-phenyl)-1H-pyrazolo[3,4-b]pyridine Formula: C20H21N3 MolecularWeight: 303.40084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=C(C=CC(=C1)C2=C3C=NNC3=NC=C2)C

Isomeric SMILES

CCCCCC#CC1=C(C=CC(=C1)C2=C3C=NNC3=NC=C2)C

InChI

InChI=1S/C20H21N3/c1-3-4-5-6-7-8-16-13-17(10-9-15(16)2)18-11-12-21-20-19(18)14-22-23-20/h9-14H,3-6H2,1-2H3,(H,21,22,23)