4-bromanyl-2-[(R)-(4-methylphenyl)-thiomorpholin-4-ium-4-yl-methyl]phenol

Systemtic Name: 4-bromanyl-2-[(R)-(4-methylphenyl)-thiomorpholin-4-ium-4-yl-methyl]phenol Openeye Name: 4-bromo-2-[(R)-p-tolyl(thiomorpholin-4-ium-4-yl)methyl]phenol CAS Name: 4-bromo-2-[(R)-(4-methylphenyl)-(4-thiomorpholin-4-iumyl)methyl]phenol IUPAC Name: 4-bromo-2-[(R)-(4-methylphenyl)-thiomorpholin-4-ium-4-ylmethyl]phenol Traditional Name: 4-bromo-2-[(R)-p-tolyl(thiomorpholin-4-ium-4-yl)methyl]phenol Formula: C18H21BrNOS+ MolecularWeight: 379.33444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)O)[NH+]3CCSCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=C(C=CC(=C2)Br)O)[NH+]3CCSCC3

InChI

InChI=1S/C18H20BrNOS/c1-13-2-4-14(5-3-13)18(20-8-10-22-11-9-20)16-12-15(19)6-7-17(16)21/h2-7,12,18,21H,8-11H2,1H3/p+1/t18-/m1/s1