[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)azanium Openeye Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)ammonium CAS Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)azanium Traditional Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)ammonium Formula: C20H30N3O4S+ MolecularWeight: 408.5349

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

InChI

InChI=1S/C20H29N3O4S/c1-22(10-13-27-19-6-4-3-5-7-19)15-18-14-21-20(23(18)11-12-26-2)28(24,25)16-17-8-9-17/h3-7,14,17H,8-13,15-16H2,1-2H3/p+1