(3S)-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-phenyl-pyrrolidin-1-ium-3-ol

Systemtic Name: (3S)-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-phenyl-pyrrolidin-1-ium-3-ol Openeye Name: (3S)-1-[2-(2-methylthiazol-4-yl)ethyl]-3-phenyl-pyrrolidin-1-ium-3-ol CAS Name: (3S)-1-[2-(2-methyl-4-thiazolyl)ethyl]-3-phenyl-3-pyrrolidin-1-iumol IUPAC Name: (3S)-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-phenylpyrrolidin-1-ium-3-ol Traditional Name: (3S)-1-[2-(2-methylthiazol-4-yl)ethyl]-3-phenyl-pyrrolidin-1-ium-3-ol Formula: C16H21N2OS+ MolecularWeight: 289.41574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CC[NH+]2CCC(C2)(C3=CC=CC=C3)O

Isomeric SMILES

CC1=NC(=CS1)CC[NH+]2CC[C@@](C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C16H20N2OS/c1-13-17-15(11-20-13)7-9-18-10-8-16(19,12-18)14-5-3-2-4-6-14/h2-6,11,19H,7-10,12H2,1H3/p+1/t16-/m1/s1