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

Systemtic Name: [2-(2-methoxyethylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl-bis(prop-2-enyl)azanium Openeye Name: diallyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]ammonium CAS Name: [2-(2-methoxyethylsulfonyl)-3-(phenylmethyl)-4-imidazolyl]methyl-bis(prop-2-enyl)ammonium IUPAC Name: [3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl-bis(prop-2-enyl)azanium Traditional Name: diallyl-[[3-benzyl-2-(2-methoxyethylsulfonyl)imidazol-4-yl]methyl]ammonium Formula: C20H28N3O3S+ MolecularWeight: 390.51962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)C[NH+](CC=C)CC=C

Isomeric SMILES

COCCS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)C[NH+](CC=C)CC=C

InChI

InChI=1S/C20H27N3O3S/c1-4-11-22(12-5-2)17-19-15-21-20(27(24,25)14-13-26-3)23(19)16-18-9-7-6-8-10-18/h4-10,15H,1-2,11-14,16-17H2,3H3/p+1