2-[3-(3,5-ditert-butylphenyl)pyrazolo[3,4-b]pyridin-1-yl]ethyl ethanoate

Systemtic Name: 2-[3-(3,5-ditert-butylphenyl)pyrazolo[3,4-b]pyridin-1-yl]ethyl ethanoate Openeye Name: 2-[3-(3,5-ditert-butylphenyl)pyrazolo[3,4-b]pyridin-1-yl]ethyl acetate CAS Name: acetic acid 2-[3-(3,5-ditert-butylphenyl)-1-pyrazolo[3,4-b]pyridinyl]ethyl ester IUPAC Name: 2-[3-(3,5-ditert-butylphenyl)pyrazolo[3,4-b]pyridin-1-yl]ethyl acetate Traditional Name: acetic acid 2-[3-(3,5-ditert-butylphenyl)pyrazolo[3,4-b]pyridin-1-yl]ethyl ester Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C2=C(C=CC=N2)C(=N1)C3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(=O)OCCN1C2=C(C=CC=N2)C(=N1)C3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C24H31N3O2/c1-16(28)29-12-11-27-22-20(9-8-10-25-22)21(26-27)17-13-18(23(2,3)4)15-19(14-17)24(5,6)7/h8-10,13-15H,11-12H2,1-7H3