(E)-1-(2-ethylpiperidin-1-yl)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]but-2-en-1-one

Systemtic Name: (E)-1-(2-ethylpiperidin-1-yl)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]but-2-en-1-one Openeye Name: (E)-1-(2-ethyl-1-piperidyl)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]but-2-en-1-one CAS Name: (E)-1-(2-ethyl-1-piperidinyl)-3-[6-methoxy-3-(4-methylphenyl)-5-benzofuranyl]-2-buten-1-one IUPAC Name: (E)-1-(2-ethylpiperidin-1-yl)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]but-2-en-1-one Traditional Name: (E)-1-(2-ethylpiperidino)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]but-2-en-1-one Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C=C(C)C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)C)OC

Isomeric SMILES

CCC1CCCCN1C(=O)/C=C(\C)/C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)C)OC

InChI

InChI=1S/C27H31NO3/c1-5-21-8-6-7-13-28(21)27(29)14-19(3)22-15-23-24(20-11-9-18(2)10-12-20)17-31-26(23)16-25(22)30-4/h9-12,14-17,21H,5-8,13H2,1-4H3/b19-14+