4-methyl-3-[(4-nitrophenyl)methyl]-1,3-thiazol-3-ium chloride

Systemtic Name: 4-methyl-3-[(4-nitrophenyl)methyl]-1,3-thiazol-3-ium chloride Openeye Name: 4-methyl-3-[(4-nitrophenyl)methyl]thiazol-3-ium chloride CAS Name: 4-methyl-3-[(4-nitrophenyl)methyl]thiazol-3-ium chloride IUPAC Name: 4-methyl-3-[(4-nitrophenyl)methyl]-1,3-thiazol-3-ium chloride Traditional Name: 4-methyl-3-(4-nitrobenzyl)thiazol-3-ium chloride Formula: C11H11ClN2O2S MolecularWeight: 270.73524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC=[N+]1CC2=CC=C(C=C2)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC1=CSC=[N+]1CC2=CC=C(C=C2)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C11H11N2O2S.ClH/c1-9-7-16-8-12(9)6-10-2-4-11(5-3-10)13(14)15;/h2-5,7-8H,6H2,1H3;1H/q+1;/p-1