dicyclopropylmethyl-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-azanium

Systemtic Name: dicyclopropylmethyl-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-azanium Openeye Name: dicyclopropylmethyl-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-ammonium CAS Name: dicyclopropylmethyl-[(2-ethylsulfonyl-3-phenethyl-4-imidazolyl)methyl]-methylammonium IUPAC Name: dicyclopropylmethyl-[(2-ethylsulfonyl-3-phenethylimidazol-4-yl)methyl]-methylazanium Traditional Name: dicyclopropylmethyl-[(2-esyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-ammonium Formula: C22H32N3O2S+ MolecularWeight: 402.57338

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)C[NH+](C)C(C3CC3)C4CC4

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)C[NH+](C)C(C3CC3)C4CC4

InChI

InChI=1S/C22H31N3O2S/c1-3-28(26,27)22-23-15-20(25(22)14-13-17-7-5-4-6-8-17)16-24(2)21(18-9-10-18)19-11-12-19/h4-8,15,18-19,21H,3,9-14,16H2,1-2H3/p+1