(3E)-3-[(3,4-diethoxyphenyl)methylidene]-6,7-diethoxy-2,4-dihydro-1H-isoquinoline

Systemtic Name: (3E)-3-[(3,4-diethoxyphenyl)methylidene]-6,7-diethoxy-2,4-dihydro-1H-isoquinoline Openeye Name: (3E)-3-[(3,4-diethoxyphenyl)methylene]-6,7-diethoxy-2,4-dihydro-1H-isoquinoline CAS Name: (3E)-3-[(3,4-diethoxyphenyl)methylidene]-6,7-diethoxy-2,4-dihydro-1H-isoquinoline IUPAC Name: (3E)-3-[(3,4-diethoxyphenyl)methylidene]-6,7-diethoxy-2,4-dihydro-1H-isoquinoline Traditional Name: (3E)-3-(3,4-diethoxybenzylidene)-6,7-diethoxy-2,4-dihydro-1H-isoquinoline Formula: C24H31NO4 MolecularWeight: 397.50724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C2CC3=CC(=C(C=C3CN2)OCC)OCC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/2\CC3=CC(=C(C=C3CN2)OCC)OCC)OCC

InChI

InChI=1S/C24H31NO4/c1-5-26-21-10-9-17(12-22(21)27-6-2)11-20-13-18-14-23(28-7-3)24(29-8-4)15-19(18)16-25-20/h9-12,14-15,25H,5-8,13,16H2,1-4H3/b20-11+