ethyl-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-(2-hydroxyethyl)azanium

Systemtic Name: ethyl-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-(2-hydroxyethyl)azanium Openeye Name: ethyl-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-(2-hydroxyethyl)ammonium CAS Name: ethyl-[[2-ethylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]-(2-hydroxyethyl)ammonium IUPAC Name: ethyl-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-(2-hydroxyethyl)azanium Traditional Name: [2-esyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-ethyl-(2-hydroxyethyl)ammonium Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCO)CC1=CN=C(N1CCCC2=CC=CC=C2)S(=O)(=O)CC

Isomeric SMILES

CC[NH+](CCO)CC1=CN=C(N1CCCC2=CC=CC=C2)S(=O)(=O)CC

InChI

InChI=1S/C19H29N3O3S/c1-3-21(13-14-23)16-18-15-20-19(26(24,25)4-2)22(18)12-8-11-17-9-6-5-7-10-17/h5-7,9-10,15,23H,3-4,8,11-14,16H2,1-2H3/p+1