propan-2-yl 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]ethanoate

Systemtic Name: propan-2-yl 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]ethanoate Openeye Name: isopropyl 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]acetate CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]acetate Traditional Name: 2-(4-brosylpiperazin-1-ium-1-yl)acetic acid isopropyl ester Formula: C15H22BrN2O4S+ MolecularWeight: 406.31518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21BrN2O4S/c1-12(2)22-15(19)11-17-7-9-18(10-8-17)23(20,21)14-5-3-13(16)4-6-14/h3-6,12H,7-11H2,1-2H3/p+1