ethyl (E)-3-(1-ethyl-4,6-diphenyl-pyrazolo[3,4-b]pyridin-5-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(1-ethyl-4,6-diphenyl-pyrazolo[3,4-b]pyridin-5-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(1-ethyl-4,6-diphenyl-pyrazolo[3,4-b]pyridin-5-yl)prop-2-enoate CAS Name: (E)-3-(1-ethyl-4,6-diphenyl-5-pyrazolo[3,4-b]pyridinyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-ethyl-4,6-diphenylpyrazolo[3,4-b]pyridin-5-yl)prop-2-enoate Traditional Name: (E)-3-(1-ethyl-4,6-diphenyl-pyrazolo[3,4-b]pyridin-5-yl)acrylic acid ethyl ester Formula: C25H23N3O2 MolecularWeight: 397.46902

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=C(C(=C2C=N1)C3=CC=CC=C3)C=CC(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=NC(=C(C(=C2C=N1)C3=CC=CC=C3)/C=C/C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2/c1-3-28-25-21(17-26-28)23(18-11-7-5-8-12-18)20(15-16-22(29)30-4-2)24(27-25)19-13-9-6-10-14-19/h5-17H,3-4H2,1-2H3/b16-15+