(2S)-2-[[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-4-(2-methylpropyl)morpholin-4-ium

Systemtic Name: (2S)-2-[[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-4-(2-methylpropyl)morpholin-4-ium Openeye Name: (2S)-2-[[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-4-isobutyl-morpholin-4-ium CAS Name: (2S)-2-[[4-(2-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-4-(2-methylpropyl)morpholin-4-ium IUPAC Name: (2S)-2-[[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-4-(2-methylpropyl)morpholin-4-ium Traditional Name: (2S)-2-[[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-4-isobutyl-morpholin-4-ium Formula: C19H32ClN3O3S+2 MolecularWeight: 417.99368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCOC(C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)C[NH+]1CCO[C@H](C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H30ClN3O3S/c1-16(2)13-22-11-12-26-17(15-22)14-21-7-9-23(10-8-21)27(24,25)19-6-4-3-5-18(19)20/h3-6,16-17H,7-15H2,1-2H3/p+2/t17-/m0/s1