1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidine

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidine Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-bromo-5-isopropoxy-phenyl)methyl]piperidine CAS Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]piperidine IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]piperidine Traditional Name: 4-(2-bromo-5-isopropoxy-benzyl)-1-homopiperonyl-piperidine Formula: C24H30BrNO3 MolecularWeight: 460.4039

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H30BrNO3/c1-17(2)29-21-4-5-22(25)20(15-21)13-19-8-11-26(12-9-19)10-7-18-3-6-23-24(14-18)28-16-27-23/h3-6,14-15,17,19H,7-13,16H2,1-2H3