(E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-en-1-one

Systemtic Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-en-1-one Openeye Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-en-1-one CAS Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3,7-trimethyl-5-benzofuranyl)-2-buten-1-one IUPAC Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-en-1-one Traditional Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-en-1-one Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C(OC2=C1C)C)C)C(=CC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CCOC1=C(C=C2C(=C(OC2=C1C)C)C)/C(=C/C(=O)N3CCC4=CC=CC=C4C3)/C

InChI

InChI=1S/C26H29NO3/c1-6-29-25-18(4)26-23(17(3)19(5)30-26)14-22(25)16(2)13-24(28)27-12-11-20-9-7-8-10-21(20)15-27/h7-10,13-14H,6,11-12,15H2,1-5H3/b16-13+