1-[4-(hydroxymethyl)phenyl]-2-[1-(phenylmethyl)piperidin-4-yl]ethanone hydrate

Systemtic Name: 1-[4-(hydroxymethyl)phenyl]-2-[1-(phenylmethyl)piperidin-4-yl]ethanone hydrate Openeye Name: 2-(1-benzyl-4-piperidyl)-1-[4-(hydroxymethyl)phenyl]ethanone hydrate CAS Name: 1-[4-(hydroxymethyl)phenyl]-2-[1-(phenylmethyl)-4-piperidinyl]ethanone hydrate IUPAC Name: 2-(1-benzylpiperidin-4-yl)-1-[4-(hydroxymethyl)phenyl]ethanone hydrate Traditional Name: 2-(1-benzyl-4-piperidyl)-1-(4-methylolphenyl)ethanone hydrate Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)C2=CC=C(C=C2)CO)CC3=CC=CC=C3.O

Isomeric SMILES

C1CN(CCC1CC(=O)C2=CC=C(C=C2)CO)CC3=CC=CC=C3.O

InChI

InChI=1S/C21H25NO2.H2O/c23-16-19-6-8-20(9-7-19)21(24)14-17-10-12-22(13-11-17)15-18-4-2-1-3-5-18;/h1-9,17,23H,10-16H2;1H2