3-[[4-[2-(1,3-benzodioxol-4-yl)ethyl]piperidin-1-yl]methyl]-5-bromanyl-2-methoxy-pyridine

Systemtic Name: 3-[[4-[2-(1,3-benzodioxol-4-yl)ethyl]piperidin-1-yl]methyl]-5-bromanyl-2-methoxy-pyridine Openeye Name: 3-[[4-[2-(1,3-benzodioxol-4-yl)ethyl]-1-piperidyl]methyl]-5-bromo-2-methoxy-pyridine CAS Name: 3-[[4-[2-(1,3-benzodioxol-4-yl)ethyl]-1-piperidinyl]methyl]-5-bromo-2-methoxypyridine IUPAC Name: 3-[[4-[2-(1,3-benzodioxol-4-yl)ethyl]piperidin-1-yl]methyl]-5-bromo-2-methoxypyridine Traditional Name: 3-[[4-[2-(1,3-benzodioxol-4-yl)ethyl]piperidino]methyl]-5-bromo-2-methoxy-pyridine Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1CN2CCC(CC2)CCC3=C4C(=CC=C3)OCO4)Br

Isomeric SMILES

COC1=NC=C(C=C1CN2CCC(CC2)CCC3=C4C(=CC=C3)OCO4)Br

InChI

InChI=1S/C21H25BrN2O3/c1-25-21-17(11-18(22)12-23-21)13-24-9-7-15(8-10-24)5-6-16-3-2-4-19-20(16)27-14-26-19/h2-4,11-12,15H,5-10,13-14H2,1H3