(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-1-[4-(3-methylphenyl)piperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-1-[4-(3-methylphenyl)piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)-1-[4-(m-tolyl)piperazin-1-yl]but-2-en-1-one CAS Name: (E)-3-(6-methoxy-3,7-dimethyl-5-benzofuranyl)-1-[4-(3-methylphenyl)-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-1-[4-(3-methylphenyl)piperazin-1-yl]but-2-en-1-one Traditional Name: (E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)-1-[4-(m-tolyl)piperazino]but-2-en-1-one Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C=C(C)C3=C(C(=C4C(=C3)C(=CO4)C)C)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)/C=C(\C)/C3=C(C(=C4C(=C3)C(=CO4)C)C)OC

InChI

InChI=1S/C26H30N2O3/c1-17-7-6-8-21(13-17)27-9-11-28(12-10-27)24(29)14-18(2)22-15-23-19(3)16-31-26(23)20(4)25(22)30-5/h6-8,13-16H,9-12H2,1-5H3/b18-14+