methyl 1-(6-oxidanyl-2-propan-2-yl-1H-benzimidazol-4-yl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(6-oxidanyl-2-propan-2-yl-1H-benzimidazol-4-yl)piperidine-4-carboxylate Openeye Name: methyl 1-(6-hydroxy-2-isopropyl-1H-benzimidazol-4-yl)piperidine-4-carboxylate CAS Name: 1-(6-hydroxy-2-propan-2-yl-1H-benzimidazol-4-yl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(6-hydroxy-2-propan-2-yl-1H-benzimidazol-4-yl)piperidine-4-carboxylate Traditional Name: 1-(6-hydroxy-2-isopropyl-1H-benzimidazol-4-yl)isonipecotic acid methyl ester Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=C(C=C2N1)O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC(C)C1=NC2=C(C=C(C=C2N1)O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C17H23N3O3/c1-10(2)16-18-13-8-12(21)9-14(15(13)19-16)20-6-4-11(5-7-20)17(22)23-3/h8-11,21H,4-7H2,1-3H3,(H,18,19)