3-[1-[2-[3-(hydroxymethyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-[3-(hydroxymethyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-hydroxy-2-(4-hydroxy-3-methylol-phenyl)ethyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(C4=CC(=C(C=C4)O)CO)O

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(C4=CC(=C(C=C4)O)CO)O

InChI

InChI=1S/C21H25N3O4/c25-13-15-11-14(5-6-19(15)26)20(27)12-23-9-7-16(8-10-23)24-18-4-2-1-3-17(18)22-21(24)28/h1-6,11,16,20,25-27H,7-10,12-13H2,(H,22,28)