3-(1,3-benzodioxol-5-yl)-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-piperidyl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidino]propan-1-one Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)C(=O)CCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)C(=O)CCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H28N2O4/c28-24(8-6-18-5-7-22-23(15-18)31-17-30-22)26-12-10-20(11-13-26)25(29)27-14-9-19-3-1-2-4-21(19)16-27/h1-5,7,15,20H,6,8-14,16-17H2