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

Systemtic Name: tert-butyl 3-[2-azanyl-3-(methylcarbamoyl)-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-amino-6-(2-benzyloxyphenyl)-3-(methylcarbamoyl)-4-pyridyl]piperidine-1-carboxylate CAS Name: 3-[2-amino-3-(methylcarbamoyl)-6-(2-phenylmethoxyphenyl)-4-pyridinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-amino-3-(methylcarbamoyl)-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-1-carboxylate Traditional Name: 3-[2-amino-6-(2-benzoxyphenyl)-3-(methylcarbamoyl)-4-pyridyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H36N4O4 MolecularWeight: 516.63124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C2=CC(=NC(=C2C(=O)NC)N)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C2=CC(=NC(=C2C(=O)NC)N)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C30H36N4O4/c1-30(2,3)38-29(36)34-16-10-13-21(18-34)23-17-24(33-27(31)26(23)28(35)32-4)22-14-8-9-15-25(22)37-19-20-11-6-5-7-12-20/h5-9,11-12,14-15,17,21H,10,13,16,18-19H2,1-4H3,(H2,31,33)(H,32,35)