(3R,4R)-1-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)piperidin-3-ol

Systemtic Name: (3R,4R)-1-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)piperidin-3-ol Openeye Name: (3R,4R)-1-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-4-[4-(2-pyridyl)piperazin-1-yl]piperidin-3-ol CAS Name: (3R,4R)-1-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-4-[4-(2-pyridinyl)-1-piperazinyl]-3-piperidinol IUPAC Name: (3R,4R)-1-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)piperidin-3-ol Traditional Name: (3R,4R)-1-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-4-[4-(2-pyridyl)piperazino]piperidin-3-ol Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1CN3CCC(C(C3)O)N4CCN(CC4)C5=CC=CC=N5)OCO2

Isomeric SMILES

COC1=CC2=C(C=C1CN3CC[C@H]([C@@H](C3)O)N4CCN(CC4)C5=CC=CC=N5)OCO2

InChI

InChI=1S/C23H30N4O4/c1-29-20-13-22-21(30-16-31-22)12-17(20)14-25-7-5-18(19(28)15-25)26-8-10-27(11-9-26)23-4-2-3-6-24-23/h2-4,6,12-13,18-19,28H,5,7-11,14-16H2,1H3/t18-,19-/m1/s1