[2-(2-methoxyethylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [2-(2-methoxyethylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]-methyl-ammonium CAS Name: [2-(2-methoxyethylsulfonyl)-3-(phenylmethyl)-4-imidazolyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]-methylazanium Traditional Name: benzyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]-methyl-ammonium Formula: C22H28N3O3S+ MolecularWeight: 414.54102

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=CN=C(N2CC3=CC=CC=C3)S(=O)(=O)CCOC

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=CN=C(N2CC3=CC=CC=C3)S(=O)(=O)CCOC

InChI

InChI=1S/C22H27N3O3S/c1-24(16-19-9-5-3-6-10-19)18-21-15-23-22(29(26,27)14-13-28-2)25(21)17-20-11-7-4-8-12-20/h3-12,15H,13-14,16-18H2,1-2H3/p+1