butyl 2-[1-[(4-methoxyphenyl)methyl]-4-methyl-3-oxidanylidene-2-phenyl-pyrazolo[3,4-b]pyridin-6-yl]ethanoate

Systemtic Name: butyl 2-[1-[(4-methoxyphenyl)methyl]-4-methyl-3-oxidanylidene-2-phenyl-pyrazolo[3,4-b]pyridin-6-yl]ethanoate Openeye Name: butyl 2-[1-[(4-methoxyphenyl)methyl]-4-methyl-3-oxo-2-phenyl-pyrazolo[3,4-b]pyridin-6-yl]acetate CAS Name: 2-[1-[(4-methoxyphenyl)methyl]-4-methyl-3-oxo-2-phenyl-6-pyrazolo[3,4-b]pyridinyl]acetic acid butyl ester IUPAC Name: butyl 2-[1-[(4-methoxyphenyl)methyl]-4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]pyridin-6-yl]acetate Traditional Name: 2-(3-keto-4-methyl-1-p-anisyl-2-phenyl-pyrazolo[3,4-b]pyridin-6-yl)acetic acid butyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC1=NC2=C(C(=C1)C)C(=O)N(N2CC3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)CC1=NC2=C(C(=C1)C)C(=O)N(N2CC3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4/c1-4-5-15-34-24(31)17-21-16-19(2)25-26(28-21)29(18-20-11-13-23(33-3)14-12-20)30(27(25)32)22-9-7-6-8-10-22/h6-14,16H,4-5,15,17-18H2,1-3H3