tert-butyl 3-[[5-(3-methyl-1,2,3-triazol-4-yl)-1-benzofuran-7-yl]methoxy]-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[5-(3-methyl-1,2,3-triazol-4-yl)-1-benzofuran-7-yl]methoxy]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[5-(3-methyltriazol-4-yl)benzofuran-7-yl]methoxy]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[[5-(3-methyl-4-triazolyl)-7-benzofuranyl]methoxy]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[5-(3-methyltriazol-4-yl)-1-benzofuran-7-yl]methoxy]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-[[5-(3-methyltriazol-4-yl)benzofuran-7-yl]methoxy]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)OCC3=C4C(=CC(=C3)C5=CN=NN5C)C=CO4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)OCC3=C4C(=CC(=C3)C5=CN=NN5C)C=CO4

InChI

InChI=1S/C28H32N4O4/c1-28(2,3)36-27(33)32-13-8-11-24(25(32)19-9-6-5-7-10-19)35-18-22-16-21(23-17-29-30-31(23)4)15-20-12-14-34-26(20)22/h5-7,9-10,12,14-17,24-25H,8,11,13,18H2,1-4H3