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

Systemtic Name: 1-[(E)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-3-(6-methoxy-2,3,7-trimethyl-5-benzofuranyl)-1-oxobut-2-enyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enoyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enoyl]isonipecotamide Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C(=C(C=C12)C(=CC(=O)N3CCC(CC3)C(=O)N)C)OC)C)C

Isomeric SMILES

CC1=C(OC2=C(C(=C(C=C12)/C(=C/C(=O)N3CCC(CC3)C(=O)N)/C)OC)C)C

InChI

InChI=1S/C22H28N2O4/c1-12(10-19(25)24-8-6-16(7-9-24)22(23)26)17-11-18-13(2)15(4)28-21(18)14(3)20(17)27-5/h10-11,16H,6-9H2,1-5H3,(H2,23,26)/b12-10+