[2-(2-chloranylprop-2-enoxy)-7-methylsulfanyl-quinolin-3-yl]methyl-[(3-methyloxetan-3-yl)methyl]azanium

Systemtic Name: [2-(2-chloranylprop-2-enoxy)-7-methylsulfanyl-quinolin-3-yl]methyl-[(3-methyloxetan-3-yl)methyl]azanium Openeye Name: [2-(2-chloroallyloxy)-7-methylsulfanyl-3-quinolyl]methyl-[(3-methyloxetan-3-yl)methyl]ammonium CAS Name: [2-(2-chloroprop-2-enoxy)-7-(methylthio)-3-quinolinyl]methyl-[(3-methyl-3-oxetanyl)methyl]ammonium IUPAC Name: [2-(2-chloroprop-2-enoxy)-7-methylsulfanylquinolin-3-yl]methyl-[(3-methyloxetan-3-yl)methyl]azanium Traditional Name: [2-(2-chloroallyloxy)-7-(methylthio)-3-quinolyl]methyl-[(3-methyloxetan-3-yl)methyl]ammonium Formula: C19H24ClN2O2S+ MolecularWeight: 379.92406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC1)C[NH2+]CC2=C(N=C3C=C(C=CC3=C2)SC)OCC(=C)Cl

Isomeric SMILES

CC1(COC1)C[NH2+]CC2=C(N=C3C=C(C=CC3=C2)SC)OCC(=C)Cl

InChI

InChI=1S/C19H23ClN2O2S/c1-13(20)9-24-18-15(8-21-10-19(2)11-23-12-19)6-14-4-5-16(25-3)7-17(14)22-18/h4-7,21H,1,8-12H2,2-3H3/p+1