tert-butyl 4-(4-methoxycarbonylpiperidin-1-yl)-6-oxidanyl-2-propan-2-yl-benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 4-(4-methoxycarbonylpiperidin-1-yl)-6-oxidanyl-2-propan-2-yl-benzimidazole-1-carboxylate Openeye Name: tert-butyl 6-hydroxy-2-isopropyl-4-(4-methoxycarbonyl-1-piperidyl)benzimidazole-1-carboxylate CAS Name: 6-hydroxy-4-(4-methoxycarbonyl-1-piperidinyl)-2-propan-2-yl-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-hydroxy-4-(4-methoxycarbonylpiperidin-1-yl)-2-propan-2-ylbenzimidazole-1-carboxylate Traditional Name: 4-(4-carbomethoxypiperidino)-6-hydroxy-2-isopropyl-benzimidazole-1-carboxylic acid tert-butyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=C(C=C2N1C(=O)OC(C)(C)C)O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC(C)C1=NC2=C(C=C(C=C2N1C(=O)OC(C)(C)C)O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C22H31N3O5/c1-13(2)19-23-18-16(24-9-7-14(8-10-24)20(27)29-6)11-15(26)12-17(18)25(19)21(28)30-22(3,4)5/h11-14,26H,7-10H2,1-6H3