N,N-dimethyl-4-[(2S,5S)-5-[(4-methylphenyl)sulfanylmethyl]-1,3-oxazolidin-3-ium-2-yl]aniline

Systemtic Name: N,N-dimethyl-4-[(2S,5S)-5-[(4-methylphenyl)sulfanylmethyl]-1,3-oxazolidin-3-ium-2-yl]aniline Openeye Name: N,N-dimethyl-4-[(2S,5S)-5-(p-tolylsulfanylmethyl)oxazolidin-3-ium-2-yl]aniline CAS Name: N,N-dimethyl-4-[(2S,5S)-5-[[(4-methylphenyl)thio]methyl]-2-oxazolidin-3-iumyl]aniline IUPAC Name: N,N-dimethyl-4-[(2S,5S)-5-[(4-methylphenyl)sulfanylmethyl]-1,3-oxazolidin-3-ium-2-yl]aniline Traditional Name: dimethyl-[4-[(2S,5S)-5-[(p-tolylthio)methyl]oxazolidin-3-ium-2-yl]phenyl]amine Formula: C19H25N2OS+ MolecularWeight: 329.4796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2C[NH2+]C(O2)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC[C@@H]2C[NH2+][C@@H](O2)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C19H24N2OS/c1-14-4-10-18(11-5-14)23-13-17-12-20-19(22-17)15-6-8-16(9-7-15)21(2)3/h4-11,17,19-20H,12-13H2,1-3H3/p+1/t17-,19-/m0/s1