(E)-N-(4-bromophenyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide

Systemtic Name: (E)-N-(4-bromophenyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide Openeye Name: (E)-N-(4-bromophenyl)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-N-(4-bromophenyl)-3-(6-methoxy-2,3,7-trimethyl-5-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-(4-bromophenyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide Traditional Name: (E)-N-(4-bromophenyl)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enamide Formula: C22H22BrNO3 MolecularWeight: 428.31898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C(=C(C=C12)C(=CC(=O)NC3=CC=C(C=C3)Br)C)OC)C)C

Isomeric SMILES

CC1=C(OC2=C(C(=C(C=C12)/C(=C/C(=O)NC3=CC=C(C=C3)Br)/C)OC)C)C

InChI

InChI=1S/C22H22BrNO3/c1-12(10-20(25)24-17-8-6-16(23)7-9-17)18-11-19-13(2)15(4)27-22(19)14(3)21(18)26-5/h6-11H,1-5H3,(H,24,25)/b12-10+