(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-[(2-chlorophenyl)methyl]-methyl-azanium

Systemtic Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-[(2-chlorophenyl)methyl]-methyl-azanium Openeye Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-[(2-chlorophenyl)methyl]-methyl-ammonium CAS Name: (3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl-[(2-chlorophenyl)methyl]-methylammonium IUPAC Name: (3-butyl-2-ethylsulfonylimidazol-4-yl)methyl-[(2-chlorophenyl)methyl]-methylazanium Traditional Name: (3-butyl-2-esyl-imidazol-4-yl)methyl-(2-chlorobenzyl)-methyl-ammonium Formula: C18H27ClN3O2S+ MolecularWeight: 384.94388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CC2=CC=CC=C2Cl

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CC2=CC=CC=C2Cl

InChI

InChI=1S/C18H26ClN3O2S/c1-4-6-11-22-16(12-20-18(22)25(23,24)5-2)14-21(3)13-15-9-7-8-10-17(15)19/h7-10,12H,4-6,11,13-14H2,1-3H3/p+1