3H-benzimidazol-5-yl-[(3S)-3-(hydroxymethyl)-3-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: 3H-benzimidazol-5-yl-[(3S)-3-(hydroxymethyl)-3-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: 3H-benzimidazol-5-yl-[(3S)-3-benzyl-3-(hydroxymethyl)-1-piperidyl]methanone CAS Name: 3H-benzimidazol-5-yl-[(3S)-3-(hydroxymethyl)-3-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: 3H-benzimidazol-5-yl-[(3S)-3-benzyl-3-(hydroxymethyl)piperidin-1-yl]methanone Traditional Name: 3H-benzimidazol-5-yl-[(3S)-3-benzyl-3-methylol-piperidino]methanone Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)N=CN3)(CC4=CC=CC=C4)CO

Isomeric SMILES

C1C[C@@](CN(C1)C(=O)C2=CC3=C(C=C2)N=CN3)(CC4=CC=CC=C4)CO

InChI

InChI=1S/C21H23N3O2/c25-14-21(12-16-5-2-1-3-6-16)9-4-10-24(13-21)20(26)17-7-8-18-19(11-17)23-15-22-18/h1-3,5-8,11,15,25H,4,9-10,12-14H2,(H,22,23)/t21-/m0/s1