1-[(E)-3-(6-methoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-(6-methoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-(6-methoxy-3-phenyl-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-3-(6-methoxy-3-phenyl-5-benzofuranyl)-1-oxobut-2-enyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(6-methoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-(6-methoxy-3-phenyl-benzofuran-5-yl)but-2-enoyl]isonipecotamide Formula: C25H26N2O4 MolecularWeight: 418.48494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCC(CC1)C(=O)N)C2=C(C=C3C(=C2)C(=CO3)C4=CC=CC=C4)OC

Isomeric SMILES

C/C(=C\C(=O)N1CCC(CC1)C(=O)N)/C2=C(C=C3C(=C2)C(=CO3)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H26N2O4/c1-16(12-24(28)27-10-8-18(9-11-27)25(26)29)19-13-20-21(17-6-4-3-5-7-17)15-31-23(20)14-22(19)30-2/h3-7,12-15,18H,8-11H2,1-2H3,(H2,26,29)/b16-12+