ethyl 4-[[3-(diethylaminomethyl)-4-oxidanyl-phenyl]amino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-[[3-(diethylaminomethyl)-4-oxidanyl-phenyl]amino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-[3-(diethylaminomethyl)-4-hydroxy-anilino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-[3-(diethylaminomethyl)-4-hydroxyanilino]-3-methyl-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(diethylaminomethyl)-4-hydroxyanilino]-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-[3-(diethylaminomethyl)-4-hydroxy-anilino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)NC2=C3C(=NN(C3=NC=C2C(=O)OCC)C4=CC=CC=C4)C)O

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)NC2=C3C(=NN(C3=NC=C2C(=O)OCC)C4=CC=CC=C4)C)O

InChI

InChI=1S/C27H31N5O3/c1-5-31(6-2)17-19-15-20(13-14-23(19)33)29-25-22(27(34)35-7-3)16-28-26-24(25)18(4)30-32(26)21-11-9-8-10-12-21/h8-16,33H,5-7,17H2,1-4H3,(H,28,29)