(5-bromanyl-3-methyl-1-benzofuran-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-bromanyl-3-methyl-1-benzofuran-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-bromo-3-methyl-benzofuran-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (5-bromo-3-methyl-2-benzofuranyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-bromo-3-methyl-1-benzofuran-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-bromo-3-methyl-benzofuran-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C15H18BrN2O2+ MolecularWeight: 338.21962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C15H17BrN2O2/c1-10-12-9-11(16)3-4-13(12)20-14(10)15(19)18-7-5-17(2)6-8-18/h3-4,9H,5-8H2,1-2H3/p+1