(5-ethoxy-3-methyl-1-benzofuran-2-yl)-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-ethoxy-3-methyl-1-benzofuran-2-yl)-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (5-ethoxy-3-methyl-benzofuran-2-yl)-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (5-ethoxy-3-methyl-2-benzofuranyl)-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (5-ethoxy-3-methyl-1-benzofuran-2-yl)-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (5-ethoxy-3-methyl-benzofuran-2-yl)-[4-(5-fluoro-2-methoxy-benzyl)piperazin-4-ium-1-yl]methanone Formula: C24H28FN2O4+ MolecularWeight: 427.488523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)N3CC[NH+](CC3)CC4=C(C=CC(=C4)F)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)N3CC[NH+](CC3)CC4=C(C=CC(=C4)F)OC

InChI

InChI=1S/C24H27FN2O4/c1-4-30-19-6-8-22-20(14-19)16(2)23(31-22)24(28)27-11-9-26(10-12-27)15-17-13-18(25)5-7-21(17)29-3/h5-8,13-14H,4,9-12,15H2,1-3H3/p+1