2-(2-chloranylphenoxy)ethyl-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-methyl-azanium

Systemtic Name: 2-(2-chloranylphenoxy)ethyl-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-methyl-azanium Openeye Name: 2-(2-chlorophenoxy)ethyl-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl]-methyl-ammonium CAS Name: 2-(2-chlorophenoxy)ethyl-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl]-methylammonium IUPAC Name: 2-(2-chlorophenoxy)ethyl-[(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl]-methylazanium Traditional Name: 2-(2-chlorophenoxy)ethyl-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl]-methyl-ammonium Formula: C23H30ClN4O4S+ MolecularWeight: 494.0267

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](C)CCOC4=CC=CC=C4Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](C)CCOC4=CC=CC=C4Cl

InChI

InChI=1S/C23H29ClN4O4S/c1-3-28-21-9-8-18(33(29,30)27-11-13-31-14-12-27)16-20(21)25-23(28)17-26(2)10-15-32-22-7-5-4-6-19(22)24/h4-9,16H,3,10-15,17H2,1-2H3/p+1