1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(4-methylphenyl)piperazin-1-ium

Systemtic Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(4-methylphenyl)piperazin-1-ium Openeye Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(p-tolyl)piperazin-1-ium CAS Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]-4-(4-methylphenyl)piperazin-1-ium IUPAC Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(4-methylphenyl)piperazin-1-ium Traditional Name: 1-[[2-esyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(p-tolyl)piperazin-1-ium Formula: C20H31N4O3S+ MolecularWeight: 407.55014

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H30N4O3S/c1-4-28(25,26)20-21-15-19(24(20)13-14-27-3)16-22-9-11-23(12-10-22)18-7-5-17(2)6-8-18/h5-8,15H,4,9-14,16H2,1-3H3/p+1