(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl-[(3-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: (1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl-[(3-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: (1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl-m-anisyl-methyl-ammonium Formula: C24H33N4O3S+ MolecularWeight: 457.60882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+](C)CC4=CC(=CC=C4)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+](C)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C24H32N4O3S/c1-4-28-23-12-11-21(32(29,30)27-13-6-5-7-14-27)16-22(23)25-24(28)18-26(2)17-19-9-8-10-20(15-19)31-3/h8-12,15-16H,4-7,13-14,17-18H2,1-3H3/p+1