1-[(E)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-3-(6-methoxy-7-methyl-3-phenyl-5-benzofuranyl)-1-oxobut-2-enyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-enoyl]isonipecotamide Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1OC)C(=CC(=O)N3CCC(CC3)C(=O)N)C)C(=CO2)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC(=C1OC)/C(=C/C(=O)N3CCC(CC3)C(=O)N)/C)C(=CO2)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O4/c1-16(13-23(29)28-11-9-19(10-12-28)26(27)30)20-14-21-22(18-7-5-4-6-8-18)15-32-25(21)17(2)24(20)31-3/h4-8,13-15,19H,9-12H2,1-3H3,(H2,27,30)/b16-13+