[4-butoxy-1-(furan-2-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]-phenyl-methanone

Systemtic Name: [4-butoxy-1-(furan-2-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]-phenyl-methanone Openeye Name: [4-butoxy-1-(2-furylmethyl)pyrazolo[3,4-b]pyridin-5-yl]-phenyl-methanone CAS Name: [4-butoxy-1-(2-furanylmethyl)-5-pyrazolo[3,4-b]pyridinyl]-phenylmethanone IUPAC Name: [4-butoxy-1-(furan-2-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]-phenylmethanone Traditional Name: [4-butoxy-1-(2-furfuryl)pyrazolo[3,4-b]pyridin-5-yl]-phenyl-methanone Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C2C=NN(C2=NC=C1C(=O)C3=CC=CC=C3)CC4=CC=CO4

Isomeric SMILES

CCCCOC1=C2C=NN(C2=NC=C1C(=O)C3=CC=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C22H21N3O3/c1-2-3-11-28-21-18(20(26)16-8-5-4-6-9-16)13-23-22-19(21)14-24-25(22)15-17-10-7-12-27-17/h4-10,12-14H,2-3,11,15H2,1H3