2-[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethoxy-methyl]-3-methyl-1,3-thiazol-3-ium

Systemtic Name: 2-[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethoxy-methyl]-3-methyl-1,3-thiazol-3-ium Openeye Name: 2-[(R)-benzyloxy-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-3-methyl-thiazol-3-ium CAS Name: 2-[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethoxymethyl]-3-methylthiazol-3-ium IUPAC Name: 2-[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethoxymethyl]-3-methyl-1,3-thiazol-3-ium Traditional Name: 2-[(R)-benzoxy-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-3-methyl-thiazol-3-ium Formula: C17H22NO3S+ MolecularWeight: 320.42648

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C(C2=[N+](C=CS2)C)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1(OC[C@@H](O1)[C@H](C2=[N+](C=CS2)C)OCC3=CC=CC=C3)C

InChI

InChI=1S/C17H22NO3S/c1-17(2)20-12-14(21-17)15(16-18(3)9-10-22-16)19-11-13-7-5-4-6-8-13/h4-10,14-15H,11-12H2,1-3H3/q+1/t14-,15-/m1/s1