(6R)-2-methyl-6-[(4-methyl-6-methylsulfanyl-quinolin-1-ium-2-yl)amino]heptan-2-ol

Systemtic Name: (6R)-2-methyl-6-[(4-methyl-6-methylsulfanyl-quinolin-1-ium-2-yl)amino]heptan-2-ol Openeye Name: (6R)-2-methyl-6-[(4-methyl-6-methylsulfanyl-quinolin-1-ium-2-yl)amino]heptan-2-ol CAS Name: (6R)-2-methyl-6-[[4-methyl-6-(methylthio)-2-quinolin-1-iumyl]amino]-2-heptanol IUPAC Name: (6R)-2-methyl-6-[(4-methyl-6-methylsulfanylquinolin-1-ium-2-yl)amino]heptan-2-ol Traditional Name: (6R)-2-methyl-6-[[4-methyl-6-(methylthio)quinolin-1-ium-2-yl]amino]heptan-2-ol Formula: C19H29N2OS+ MolecularWeight: 333.51136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C=C(C=C2)SC)NC(C)CCCC(C)(C)O

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C=C(C=C2)SC)N[C@H](C)CCCC(C)(C)O

InChI

InChI=1S/C19H28N2OS/c1-13-11-18(20-14(2)7-6-10-19(3,4)22)21-17-9-8-15(23-5)12-16(13)17/h8-9,11-12,14,22H,6-7,10H2,1-5H3,(H,20,21)/p+1/t14-/m1/s1