[3-(2-methylpropyl)-2-[[(2R)-oxolan-2-yl]methylsulfonyl]imidazol-4-yl]methyl-prop-2-enyl-prop-2-ynyl-azanium

Systemtic Name: [3-(2-methylpropyl)-2-[[(2R)-oxolan-2-yl]methylsulfonyl]imidazol-4-yl]methyl-prop-2-enyl-prop-2-ynyl-azanium Openeye Name: allyl-[[3-isobutyl-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfonyl]imidazol-4-yl]methyl]-prop-2-ynyl-ammonium CAS Name: [3-(2-methylpropyl)-2-[[(2R)-2-oxolanyl]methylsulfonyl]-4-imidazolyl]methyl-prop-2-enyl-prop-2-ynylammonium IUPAC Name: [3-(2-methylpropyl)-2-[[(2R)-oxolan-2-yl]methylsulfonyl]imidazol-4-yl]methyl-prop-2-enyl-prop-2-ynylazanium Traditional Name: allyl-[[3-isobutyl-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfonyl]imidazol-4-yl]methyl]-propargyl-ammonium Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2CCCO2)C[NH+](CC=C)CC#C

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C[C@H]2CCCO2)C[NH+](CC=C)CC#C

InChI

InChI=1S/C19H29N3O3S/c1-5-9-21(10-6-2)14-17-12-20-19(22(17)13-16(3)4)26(23,24)15-18-8-7-11-25-18/h1,6,12,16,18H,2,7-11,13-15H2,3-4H3/p+1/t18-/m1/s1