3-[bis(2-hydroxyethyl)amino]-2,3-di(propan-2-yl)-2H-1,3-benzothiazol-3-ium-6-ol

Systemtic Name: 3-[bis(2-hydroxyethyl)amino]-2,3-di(propan-2-yl)-2H-1,3-benzothiazol-3-ium-6-ol Openeye Name: 3-[bis(2-hydroxyethyl)amino]-2,3-diisopropyl-2H-1,3-benzothiazol-3-ium-6-ol CAS Name: 3-[bis(2-hydroxyethyl)amino]-2,3-di(propan-2-yl)-2H-1,3-benzothiazol-3-ium-6-ol IUPAC Name: 3-[bis(2-hydroxyethyl)amino]-2,3-di(propan-2-yl)-2H-1,3-benzothiazol-3-ium-6-ol Traditional Name: 3-[bis(2-hydroxyethyl)amino]-2,3-diisopropyl-2H-1,3-benzothiazol-3-ium-6-ol Formula: C17H29N2O3S+ MolecularWeight: 341.48876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1[N+](C2=C(S1)C=C(C=C2)O)(C(C)C)N(CCO)CCO

Isomeric SMILES

CC(C)C1[N+](C2=C(S1)C=C(C=C2)O)(C(C)C)N(CCO)CCO

InChI

InChI=1S/C17H28N2O3S/c1-12(2)17-19(13(3)4,18(7-9-20)8-10-21)15-6-5-14(22)11-16(15)23-17/h5-6,11-13,17,20-21H,7-10H2,1-4H3/p+1