N-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: N-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylphenyl]ethanamide Openeye Name: N-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide CAS Name: N-[4-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide Traditional Name: N-[4-(4-pyridin-1-ium-2-ylpiperazino)sulfonylphenyl]acetamide Formula: C17H21N4O3S+ MolecularWeight: 361.43864

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C17H20N4O3S/c1-14(22)19-15-5-7-16(8-6-15)25(23,24)21-12-10-20(11-13-21)17-4-2-3-9-18-17/h2-9H,10-13H2,1H3,(H,19,22)/p+1