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

Systemtic Name: (E)-3-(1-ethyl-4,6-diphenyl-pyrazolo[3,4-b]pyridin-5-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-ethyl-4,6-diphenyl-pyrazolo[3,4-b]pyridin-5-yl)prop-2-enoic acid CAS Name: (E)-3-(1-ethyl-4,6-diphenyl-5-pyrazolo[3,4-b]pyridinyl)-2-propenoic acid IUPAC Name: (E)-3-(1-ethyl-4,6-diphenylpyrazolo[3,4-b]pyridin-5-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-ethyl-4,6-diphenyl-pyrazolo[3,4-b]pyridin-5-yl)acrylic acid Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N3O2/c1-2-26-23-19(15-24-26)21(16-9-5-3-6-10-16)18(13-14-20(27)28)22(25-23)17-11-7-4-8-12-17/h3-15H,2H2,1H3,(H,27,28)/b14-13+