1-[4-(4-propan-2-ylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone

Systemtic Name: 1-[4-(4-propan-2-ylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone Openeye Name: 1-[4-(4-isopropylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone CAS Name: 1-[4-[(4-propan-2-yl-1-piperazin-4-iumyl)sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-(4-propan-2-ylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone Traditional Name: 1-[4-(4-isopropylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone Formula: C15H23N2O3S+ MolecularWeight: 311.41972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C15H22N2O3S/c1-12(2)16-8-10-17(11-9-16)21(19,20)15-6-4-14(5-7-15)13(3)18/h4-7,12H,8-11H2,1-3H3/p+1