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

Systemtic Name: (E)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)-1-[4-(phenylmethyl)piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-(4-benzylpiperazin-1-yl)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)but-2-en-1-one CAS Name: (E)-3-(6-ethoxy-2,3-dimethyl-5-benzofuranyl)-1-[4-(phenylmethyl)-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-(4-benzylpiperazin-1-yl)-3-(6-ethoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-en-1-one Traditional Name: (E)-1-(4-benzylpiperazino)-3-(6-ethoxy-2,3-dimethyl-benzofuran-5-yl)but-2-en-1-one Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C(OC2=C1)C)C)C(=CC(=O)N3CCN(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C(OC2=C1)C)C)/C(=C/C(=O)N3CCN(CC3)CC4=CC=CC=C4)/C

InChI

InChI=1S/C27H32N2O3/c1-5-31-25-17-26-24(20(3)21(4)32-26)16-23(25)19(2)15-27(30)29-13-11-28(12-14-29)18-22-9-7-6-8-10-22/h6-10,15-17H,5,11-14,18H2,1-4H3/b19-15+