(E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-en-1-one

Systemtic Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-en-1-one Openeye Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)but-2-en-1-one CAS Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3-dimethyl-5-benzofuranyl)-2-buten-1-one IUPAC Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-en-1-one Traditional Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)but-2-en-1-one Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C(OC2=C1)C)C)C(=CC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CCOC1=C(C=C2C(=C(OC2=C1)C)C)/C(=C/C(=O)N3CCC4=CC=CC=C4C3)/C

InChI

InChI=1S/C25H27NO3/c1-5-28-23-14-24-22(17(3)18(4)29-24)13-21(23)16(2)12-25(27)26-11-10-19-8-6-7-9-20(19)15-26/h6-9,12-14H,5,10-11,15H2,1-4H3/b16-12+