1,3-benzodioxol-5-yl-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-(hydroxymethyl)-3-(o-tolylmethyl)-1-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]-1-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-(2-methylbenzyl)-3-methylol-piperidino]methanone Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2(CCCN(C2)C(=O)C3=CC4=C(C=C3)OCO4)CO

Isomeric SMILES

CC1=CC=CC=C1CC2(CCCN(C2)C(=O)C3=CC4=C(C=C3)OCO4)CO

InChI

InChI=1S/C22H25NO4/c1-16-5-2-3-6-18(16)12-22(14-24)9-4-10-23(13-22)21(25)17-7-8-19-20(11-17)27-15-26-19/h2-3,5-8,11,24H,4,9-10,12-15H2,1H3