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

Systemtic Name: 1,3-benzodioxol-5-yl-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: 1,3-benzodioxol-5-yl-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: 1,3-benzodioxol-5-yl-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: 1,3-benzodioxol-5-yl-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C23H21NO5S MolecularWeight: 423.48154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21NO5S/c1-26-18-10-14-7-8-24(23(25)15-5-6-17-20(11-15)29-13-28-17)22(21-4-3-9-30-21)16(14)12-19(18)27-2/h3-6,9-12,22H,7-8,13H2,1-2H3