ethyl 1-[(1-phenylpyrrolo[2,3-b]pyridin-2-yl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(1-phenylpyrrolo[2,3-b]pyridin-2-yl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(1-phenylpyrrolo[2,3-b]pyridin-2-yl)methyl]piperidine-3-carboxylate CAS Name: 1-[(1-phenyl-2-pyrrolo[2,3-b]pyridinyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-phenylpyrrolo[2,3-b]pyridin-2-yl)methyl]piperidine-3-carboxylate Traditional Name: 1-[(1-phenylpyrrolo[2,3-b]pyridin-2-yl)methyl]nipecotic acid ethyl ester Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=CC3=C(N2C4=CC=CC=C4)N=CC=C3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC2=CC3=C(N2C4=CC=CC=C4)N=CC=C3

InChI

InChI=1S/C22H25N3O2/c1-2-27-22(26)18-9-7-13-24(15-18)16-20-14-17-8-6-12-23-21(17)25(20)19-10-4-3-5-11-19/h3-6,8,10-12,14,18H,2,7,9,13,15-16H2,1H3