dodecyl-methyl-(3-methyl-1,3-benzothiazol-2-ylidene)azanium

Systemtic Name: dodecyl-methyl-(3-methyl-1,3-benzothiazol-2-ylidene)azanium Openeye Name: dodecyl-methyl-(3-methyl-1,3-benzothiazol-2-ylidene)ammonium CAS Name: dodecyl-methyl-(3-methyl-1,3-benzothiazol-2-ylidene)ammonium IUPAC Name: dodecyl-methyl-(3-methyl-1,3-benzothiazol-2-ylidene)azanium Traditional Name: lauryl-methyl-(3-methyl-1,3-benzothiazol-2-ylidene)ammonium Formula: C21H35N2S+ MolecularWeight: 347.581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](=C1N(C2=CC=CC=C2S1)C)C

Isomeric SMILES

CCCCCCCCCCCC[N+](=C1N(C2=CC=CC=C2S1)C)C

InChI

InChI=1S/C21H35N2S/c1-4-5-6-7-8-9-10-11-12-15-18-22(2)21-23(3)19-16-13-14-17-20(19)24-21/h13-14,16-17H,4-12,15,18H2,1-3H3/q+1