3-[2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethylsulfonyl]propanamide

Systemtic Name: 3-[2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethylsulfonyl]propanamide Openeye Name: 3-[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]ethylsulfonyl]propanamide CAS Name: 3-[2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]ethylsulfonyl]propanamide IUPAC Name: 3-[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]ethylsulfonyl]propanamide Traditional Name: 3-[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]ethylsulfonyl]propionamide Formula: C17H26N3O4S+ MolecularWeight: 368.47104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CCS(=O)(=O)CCC(=O)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CCS(=O)(=O)CCC(=O)N

InChI

InChI=1S/C17H25N3O4S/c1-14(21)15-2-4-16(5-3-15)20-9-7-19(8-10-20)11-13-25(23,24)12-6-17(18)22/h2-5H,6-13H2,1H3,(H2,18,22)/p+1