[4-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]methylazanium

Systemtic Name: [4-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]methylazanium Openeye Name: [4-(4-acetylpiperazin-1-yl)sulfonylphenyl]methylammonium CAS Name: [4-[(4-acetyl-1-piperazinyl)sulfonyl]phenyl]methylammonium IUPAC Name: [4-(4-acetylpiperazin-1-yl)sulfonylphenyl]methylazanium Traditional Name: [4-(4-acetylpiperazino)sulfonylbenzyl]ammonium Formula: C13H20N3O3S+ MolecularWeight: 298.3812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C13H19N3O3S/c1-11(17)15-6-8-16(9-7-15)20(18,19)13-4-2-12(10-14)3-5-13/h2-5H,6-10,14H2,1H3/p+1