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

Systemtic Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-[(4-ethylphenyl)methyl]-methyl-azanium Openeye Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-[(4-ethylphenyl)methyl]-methyl-ammonium CAS Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl-[(4-ethylphenyl)methyl]-methylammonium IUPAC Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-(4-ethylbenzyl)-methyl-ammonium Formula: C21H32N3O3S+ MolecularWeight: 406.56208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

InChI

InChI=1S/C21H31N3O3S/c1-4-17-5-7-18(8-6-17)14-23(2)15-20-13-22-21(24(20)11-12-27-3)28(25,26)16-19-9-10-19/h5-8,13,19H,4,9-12,14-16H2,1-3H3/p+1