tert-butyl 3-[2-azanyl-3-(azidomethyl)-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-azanyl-3-(azidomethyl)-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-amino-3-(azidomethyl)-6-(2-benzyloxyphenyl)-4-pyridyl]piperidine-1-carboxylate CAS Name: 3-[2-amino-3-(azidomethyl)-6-(2-phenylmethoxyphenyl)-4-pyridinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-amino-3-(azidomethyl)-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-1-carboxylate Traditional Name: 3-[2-amino-3-(azidomethyl)-6-(2-benzoxyphenyl)-4-pyridyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H34N6O3 MolecularWeight: 514.61866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C2=CC(=NC(=C2CN=[N+]=[N-])N)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C2=CC(=NC(=C2CN=[N+]=[N-])N)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C29H34N6O3/c1-29(2,3)38-28(36)35-15-9-12-21(18-35)23-16-25(33-27(30)24(23)17-32-34-31)22-13-7-8-14-26(22)37-19-20-10-5-4-6-11-20/h4-8,10-11,13-14,16,21H,9,12,15,17-19H2,1-3H3,(H2,30,33)