phenyl 4-[6-(1H-indol-5-yl)-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate

Systemtic Name: phenyl 4-[6-(1H-indol-5-yl)-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate Openeye Name: phenyl 4-[6-(1H-indol-5-yl)-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate CAS Name: 4-[6-(1H-indol-5-yl)-4-(4-morpholinyl)-1-pyrazolo[3,4-d]pyrimidinyl]-1-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl 4-[6-(1H-indol-5-yl)-4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[6-(1H-indol-5-yl)-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylic acid phenyl ester Formula: C29H29N7O3 MolecularWeight: 523.58566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=N2)C(=NC(=N3)C4=CC5=C(C=C4)NC=C5)N6CCOCC6)C(=O)OC7=CC=CC=C7

Isomeric SMILES

C1CN(CCC1N2C3=C(C=N2)C(=NC(=N3)C4=CC5=C(C=C4)NC=C5)N6CCOCC6)C(=O)OC7=CC=CC=C7

InChI

InChI=1S/C29H29N7O3/c37-29(39-23-4-2-1-3-5-23)35-12-9-22(10-13-35)36-28-24(19-31-36)27(34-14-16-38-17-15-34)32-26(33-28)21-6-7-25-20(18-21)8-11-30-25/h1-8,11,18-19,22,30H,9-10,12-17H2