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

Systemtic Name: tert-butyl 3-[2-azanyl-3-ethanoyl-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[3-acetyl-2-amino-6-(2-benzyloxyphenyl)-4-pyridyl]piperidine-1-carboxylate CAS Name: 3-[3-acetyl-2-amino-6-(2-phenylmethoxyphenyl)-4-pyridinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-acetyl-2-amino-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-1-carboxylate Traditional Name: 3-[3-acetyl-2-amino-6-(2-benzoxyphenyl)-4-pyridyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H35N3O4 MolecularWeight: 501.6166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=C(C=C1C2CCCN(C2)C(=O)OC(C)(C)C)C3=CC=CC=C3OCC4=CC=CC=C4)N

Isomeric SMILES

CC(=O)C1=C(N=C(C=C1C2CCCN(C2)C(=O)OC(C)(C)C)C3=CC=CC=C3OCC4=CC=CC=C4)N

InChI

InChI=1S/C30H35N3O4/c1-20(34)27-24(22-13-10-16-33(18-22)29(35)37-30(2,3)4)17-25(32-28(27)31)23-14-8-9-15-26(23)36-19-21-11-6-5-7-12-21/h5-9,11-12,14-15,17,22H,10,13,16,18-19H2,1-4H3,(H2,31,32)