1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone

Systemtic Name: 1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone Openeye Name: 1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone CAS Name: 1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-2-(1-pyrrolidin-1-iumyl)ethanone IUPAC Name: 1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-2-pyrrolidin-1-ium-1-ylethanone Traditional Name: 1-(4-p-cumenylsulfonylpiperazino)-2-pyrrolidin-1-ium-1-yl-ethanone Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH+]3CCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH+]3CCCC3

InChI

InChI=1S/C19H29N3O3S/c1-16(2)17-5-7-18(8-6-17)26(24,25)22-13-11-21(12-14-22)19(23)15-20-9-3-4-10-20/h5-8,16H,3-4,9-15H2,1-2H3/p+1