methyl 4-[(4R,5S)-5-benzamido-3-methyl-6-oxidanylidene-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate

Systemtic Name: methyl 4-[(4R,5S)-5-benzamido-3-methyl-6-oxidanylidene-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate Openeye Name: methyl 4-[(4R,5S)-5-benzamido-3-methyl-6-oxo-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate CAS Name: 4-[(4R,5S)-5-benzamido-3-methyl-6-oxo-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4R,5S)-5-benzamido-3-methyl-6-oxo-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoate Traditional Name: 4-[(4R,5S)-5-benzamido-6-keto-3-methyl-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoic acid methyl ester Formula: C28H24N4O4 MolecularWeight: 480.51456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(C(C(=O)N=C2N(N1)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

CC1=C2[C@H]([C@@H](C(=O)N=C2N(N1)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C28H24N4O4/c1-17-22-23(18-13-15-20(16-14-18)28(35)36-2)24(29-26(33)19-9-5-3-6-10-19)27(34)30-25(22)32(31-17)21-11-7-4-8-12-21/h3-16,23-24,31H,1-2H3,(H,29,33)/t23-,24+/m1/s1