N-(3-ethanoylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-(3-ethanoylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-(3-acetylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-(3-acetylphenyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-(3-acetylphenyl)-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-(3-acetylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C15H22N3O4S+ MolecularWeight: 340.41788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C15H21N3O4S/c1-12(19)13-3-2-4-14(11-13)17-15(20)5-10-23(21,22)18-8-6-16-7-9-18/h2-4,11,16H,5-10H2,1H3,(H,17,20)/p+1