1,3-benzodioxol-5-yl-[4-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]carbonylpiperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]carbonylpiperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[3-ethoxy-4-(3-pyridylmethoxy)benzoyl]piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[[3-ethoxy-4-(3-pyridinylmethoxy)phenyl]-oxomethyl]-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-[3-ethoxy-4-(pyridin-3-ylmethoxy)benzoyl]piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-[3-ethoxy-4-(3-pyridylmethoxy)benzoyl]piperazino]methanone Formula: C27H27N3O6 MolecularWeight: 489.51978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4)OCC5=CN=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4)OCC5=CN=CC=C5

InChI

InChI=1S/C27H27N3O6/c1-2-33-24-14-20(5-7-22(24)34-17-19-4-3-9-28-16-19)26(31)29-10-12-30(13-11-29)27(32)21-6-8-23-25(15-21)36-18-35-23/h3-9,14-16H,2,10-13,17-18H2,1H3