ethyl 1-[(E)-2-phenylethenyl]-4-(propylamino)pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 1-[(E)-2-phenylethenyl]-4-(propylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(propylamino)-1-[(E)-styryl]pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-[(E)-2-phenylethenyl]-4-(propylamino)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-2-phenylethenyl]-4-(propylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-(propylamino)-1-[(E)-styryl]pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C2C=NN(C2=NC=C1C(=O)OCC)C=CC3=CC=CC=C3

Isomeric SMILES

CCCNC1=C2C=NN(C2=NC=C1C(=O)OCC)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2/c1-3-11-21-18-16-14-23-24(12-10-15-8-6-5-7-9-15)19(16)22-13-17(18)20(25)26-4-2/h5-10,12-14H,3-4,11H2,1-2H3,(H,21,22)/b12-10+