2-[[4-(4-chlorophenyl)-4-phenylmethoxy-piperidin-3-yl]oxymethyl]-4,5-dimethoxy-N-oxidanyl-benzeneamine oxide

Systemtic Name: 2-[[4-(4-chlorophenyl)-4-phenylmethoxy-piperidin-3-yl]oxymethyl]-4,5-dimethoxy-N-oxidanyl-benzeneamine oxide Openeye Name: 2-[[4-benzyloxy-4-(4-chlorophenyl)-3-piperidyl]oxymethyl]-N-hydroxy-4,5-dimethoxy-benzeneamine oxide CAS Name: 2-[[4-(4-chlorophenyl)-4-phenylmethoxy-3-piperidinyl]oxymethyl]-N-hydroxy-4,5-dimethoxybenzeneamine oxide IUPAC Name: 2-[[4-(4-chlorophenyl)-4-phenylmethoxypiperidin-3-yl]oxymethyl]-N-hydroxy-4,5-dimethoxybenzeneamine oxide Traditional Name: 2-[[4-benzoxy-4-(4-chlorophenyl)-3-piperidyl]oxymethyl]-N-hydroxy-4,5-dimethoxy-benzeneamine oxide Formula: C27H31ClN2O6 MolecularWeight: 514.99784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC2CNCCC2(C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4)[NH+](O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC2CNCCC2(C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4)[NH+](O)[O-])OC

InChI

InChI=1S/C27H31ClN2O6/c1-33-24-14-20(23(30(31)32)15-25(24)34-2)18-35-26-16-29-13-12-27(26,21-8-10-22(28)11-9-21)36-17-19-6-4-3-5-7-19/h3-11,14-15,26,29-31H,12-13,16-18H2,1-2H3