(5-ethoxy-2-phenyl-1-benzofuran-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-ethoxy-2-phenyl-1-benzofuran-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-ethoxy-2-phenyl-benzofuran-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (5-ethoxy-2-phenyl-3-benzofuranyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-ethoxy-2-phenyl-1-benzofuran-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-ethoxy-2-phenyl-benzofuran-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3/c1-3-26-17-9-10-19-18(15-17)20(21(27-19)16-7-5-4-6-8-16)22(25)24-13-11-23(2)12-14-24/h4-10,15H,3,11-14H2,1-2H3/p+1