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

Systemtic Name: ethyl-[[2-(2-methoxyethylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]-ethyl-ammonium CAS Name: ethyl-[[2-(2-methoxyethylsulfonyl)-3-(phenylmethyl)-4-imidazolyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]-ethylazanium Traditional Name: benzyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]-ethyl-ammonium Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3S/c1-3-25(17-20-10-6-4-7-11-20)19-22-16-24-23(30(27,28)15-14-29-2)26(22)18-21-12-8-5-9-13-21/h4-13,16H,3,14-15,17-19H2,1-2H3/p+1