(E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)-N-quinolin-6-yl-but-2-enamide

Systemtic Name: (E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)-N-quinolin-6-yl-but-2-enamide Openeye Name: (E)-3-(6-ethoxy-2,3,7-trimethyl-benzofuran-5-yl)-N-(6-quinolyl)but-2-enamide CAS Name: (E)-3-(6-ethoxy-2,3,7-trimethyl-5-benzofuranyl)-N-(6-quinolinyl)-2-butenamide IUPAC Name: (E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)-N-quinolin-6-ylbut-2-enamide Traditional Name: (E)-3-(6-ethoxy-2,3,7-trimethyl-benzofuran-5-yl)-N-(6-quinolyl)but-2-enamide Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C(OC2=C1C)C)C)C(=CC(=O)NC3=CC4=C(C=C3)N=CC=C4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C(OC2=C1C)C)C)/C(=C/C(=O)NC3=CC4=C(C=C3)N=CC=C4)/C

InChI

InChI=1S/C26H26N2O3/c1-6-30-25-17(4)26-22(16(3)18(5)31-26)14-21(25)15(2)12-24(29)28-20-9-10-23-19(13-20)8-7-11-27-23/h7-14H,6H2,1-5H3,(H,28,29)/b15-12+