tert-butyl 3-[5-acetamido-2-(2-phenylmethoxyphenyl)-7H-cyclopenta[b]pyridin-4-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[5-acetamido-2-(2-phenylmethoxyphenyl)-7H-cyclopenta[b]pyridin-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[5-acetamido-2-(2-benzyloxyphenyl)-7H-cyclopenta[b]pyridin-4-yl]piperidine-1-carboxylate CAS Name: 3-[5-acetamido-2-(2-phenylmethoxyphenyl)-7H-cyclopenta[b]pyridin-4-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[5-acetamido-2-(2-phenylmethoxyphenyl)-7H-cyclopenta[b]pyridin-4-yl]piperidine-1-carboxylate Traditional Name: 3-[5-acetamido-2-(2-benzoxyphenyl)-7H-1-pyrindin-4-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C33H37N3O4 MolecularWeight: 539.66458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CCC2=C1C(=CC(=N2)C3=CC=CC=C3OCC4=CC=CC=C4)C5CCCN(C5)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)NC1=CCC2=C1C(=CC(=N2)C3=CC=CC=C3OCC4=CC=CC=C4)C5CCCN(C5)C(=O)OC(C)(C)C

InChI

InChI=1S/C33H37N3O4/c1-22(37)34-27-16-17-28-31(27)26(24-13-10-18-36(20-24)32(38)40-33(2,3)4)19-29(35-28)25-14-8-9-15-30(25)39-21-23-11-6-5-7-12-23/h5-9,11-12,14-16,19,24H,10,13,17-18,20-21H2,1-4H3,(H,34,37)