1-hexyl-2-(hexylamino)-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol

Systemtic Name: 1-hexyl-2-(hexylamino)-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol Openeye Name: 1-hexyl-2-(hexylamino)-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol CAS Name: 1-hexyl-2-(hexylamino)-4-methyl-5-benzo[e][1,3]benzothiazol-1-iumol IUPAC Name: 1-hexyl-2-(hexylamino)-4-methylbenzo[e][1,3]benzothiazol-1-ium-5-ol Traditional Name: 1-hexyl-2-(hexylamino)-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol Formula: C24H35N2OS+ MolecularWeight: 399.6125

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=[N+](C2=C(S1)C(=C(C3=CC=CC=C32)O)C)CCCCCC

Isomeric SMILES

CCCCCCNC1=[N+](C2=C(S1)C(=C(C3=CC=CC=C32)O)C)CCCCCC

InChI

InChI=1S/C24H34N2OS/c1-4-6-8-12-16-25-24-26(17-13-9-7-5-2)21-19-14-10-11-15-20(19)22(27)18(3)23(21)28-24/h10-11,14-15,27H,4-9,12-13,16-17H2,1-3H3/p+1