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

Systemtic Name: 1-(4-hydroxyphenyl)-2-[1-(phenylmethyl)piperidin-4-yl]ethanone hydrate Openeye Name: 2-(1-benzyl-4-piperidyl)-1-(4-hydroxyphenyl)ethanone hydrate CAS Name: 1-(4-hydroxyphenyl)-2-[1-(phenylmethyl)-4-piperidinyl]ethanone hydrate IUPAC Name: 2-(1-benzylpiperidin-4-yl)-1-(4-hydroxyphenyl)ethanone hydrate Traditional Name: 2-(1-benzyl-4-piperidyl)-1-(4-hydroxyphenyl)ethanone hydrate Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO2.H2O/c22-19-8-6-18(7-9-19)20(23)14-16-10-12-21(13-11-16)15-17-4-2-1-3-5-17;/h1-9,16,22H,10-15H2;1H2