1-(1,3-benzodioxol-5-ylmethoxy)-3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol Openeye Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol CAS Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-2-propanol IUPAC Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol Traditional Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-piperonyloxy-propan-2-ol Formula: C26H29NO6S MolecularWeight: 483.57656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(COCC3=CC4=C(C=C3)OCO4)O)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC(COCC3=CC4=C(C=C3)OCO4)O)C5=CC=CS5)OC

InChI

InChI=1S/C26H29NO6S/c1-29-22-11-18-7-8-27(26(25-4-3-9-34-25)20(18)12-23(22)30-2)13-19(28)15-31-14-17-5-6-21-24(10-17)33-16-32-21/h3-6,9-12,19,26,28H,7-8,13-16H2,1-2H3