(E)-3-(1,3-benzodioxol-5-yl)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C=CC3=CC4=C(C=C3)OCO4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)/C=C/C3=CC4=C(C=C3)OCO4)OCC

InChI

InChI=1S/C23H25NO5/c1-3-26-21-12-17-9-10-24(14-18(17)13-22(21)27-4-2)23(25)8-6-16-5-7-19-20(11-16)29-15-28-19/h5-8,11-13H,3-4,9-10,14-15H2,1-2H3/b8-6+