2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]ethanamide

Systemtic Name: 2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(5-methyl-2-furyl)methyl]acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-methyl-N-[(5-methyl-2-furanyl)methyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(5-methyl-2-furyl)methyl]acetamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H27N3O3/c1-16-4-9-20(27-16)14-22(3)21(26)15-23-10-12-24(13-11-23)19-7-5-18(6-8-19)17(2)25/h4-9H,10-15H2,1-3H3/p+1