2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(2,2-dimethylcoumaran-7-yl)oxy-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C17H24N2O3/c1-17(2)11-13-5-4-6-14(16(13)22-17)21-12-15(20)19-9-7-18(3)8-10-19/h4-6H,7-12H2,1-3H3/p+1