2-[(2R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[(2R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-2-yl]-1,3-benzothiazole Openeye Name: 2-[(2R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-2-yl]-1,3-benzothiazole CAS Name: 2-[(2R)-1-[(2-methoxyphenyl)methyl]-2-piperidin-1-iumyl]-1,3-benzothiazole IUPAC Name: 2-[(2R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-2-yl]-1,3-benzothiazole Traditional Name: 2-[(2R)-1-o-anisylpiperidin-1-ium-2-yl]-1,3-benzothiazole Formula: C20H23N2OS+ MolecularWeight: 339.47442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH+]2CCCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC=C1C[NH+]2CCCC[C@@H]2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H22N2OS/c1-23-18-11-4-2-8-15(18)14-22-13-7-6-10-17(22)20-21-16-9-3-5-12-19(16)24-20/h2-5,8-9,11-12,17H,6-7,10,13-14H2,1H3/p+1/t17-/m1/s1