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

Systemtic Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]ethanone CAS Name: 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethanone Traditional Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(2,2-dimethylcoumaran-7-yl)oxy-ethanone Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H28N2O3/c1-23(2)15-19-9-6-10-20(22(19)28-23)27-17-21(26)25-13-11-24(12-14-25)16-18-7-4-3-5-8-18/h3-10H,11-17H2,1-2H3/p+1