[(4S)-4-[(5-bromanyl-2-methyl-phenyl)sulfonylamino]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[(5-bromanyl-2-methyl-phenyl)sulfonylamino]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[(5-bromo-2-methyl-phenyl)sulfonylamino]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[(5-bromo-2-methylphenyl)sulfonylamino]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[(5-bromo-2-methylphenyl)sulfonylamino]pentyl]-diethylazanium Traditional Name: [(4S)-4-[(5-bromo-2-methyl-phenyl)sulfonylamino]pentyl]-diethyl-ammonium Formula: C16H28BrN2O2S+ MolecularWeight: 392.37472

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NS(=O)(=O)C1=C(C=CC(=C1)Br)C

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NS(=O)(=O)C1=C(C=CC(=C1)Br)C

InChI

InChI=1S/C16H27BrN2O2S/c1-5-19(6-2)11-7-8-14(4)18-22(20,21)16-12-15(17)10-9-13(16)3/h9-10,12,14,18H,5-8,11H2,1-4H3/p+1/t14-/m0/s1