(E)-1-(3,5-dimethylpiperidin-1-yl)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-en-1-one

Systemtic Name: (E)-1-(3,5-dimethylpiperidin-1-yl)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-en-1-one Openeye Name: (E)-1-(3,5-dimethyl-1-piperidyl)-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-en-1-one CAS Name: (E)-1-(3,5-dimethyl-1-piperidinyl)-3-(6-methoxy-7-methyl-3-phenyl-5-benzofuranyl)-2-buten-1-one IUPAC Name: (E)-1-(3,5-dimethylpiperidin-1-yl)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)but-2-en-1-one Traditional Name: (E)-1-(3,5-dimethylpiperidino)-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-en-1-one Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C=C(C)C2=C(C(=C3C(=C2)C(=CO3)C4=CC=CC=C4)C)OC)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)/C=C(\C)/C2=C(C(=C3C(=C2)C(=CO3)C4=CC=CC=C4)C)OC)C

InChI

InChI=1S/C27H31NO3/c1-17-11-18(2)15-28(14-17)25(29)12-19(3)22-13-23-24(21-9-7-6-8-10-21)16-31-27(23)20(4)26(22)30-5/h6-10,12-13,16-18H,11,14-15H2,1-5H3/b19-12+