1-butyl-4-(chloromethyl)-3-methyl-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 1-butyl-4-(chloromethyl)-3-methyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 1-butyl-4-(chloromethyl)-3-methyl-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 1-butyl-4-(chloromethyl)-3-methyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 1-butyl-4-(chloromethyl)-3-methyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 1-butyl-4-(chloromethyl)-3-methyl-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C12H16ClN3O MolecularWeight: 253.72794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC(=O)C=C(C2=C(N1)C)CCl

Isomeric SMILES

CCCCN1C2=NC(=O)C=C(C2=C(N1)C)CCl

InChI

InChI=1S/C12H16ClN3O/c1-3-4-5-16-12-11(8(2)15-16)9(7-13)6-10(17)14-12/h6,15H,3-5,7H2,1-2H3