[5-(1,3-benzothiazol-2-yl)-2-[2-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylamino]ethoxy]phenyl]methyl-dimethyl-azanium

Systemtic Name: [5-(1,3-benzothiazol-2-yl)-2-[2-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylamino]ethoxy]phenyl]methyl-dimethyl-azanium Openeye Name: [5-(1,3-benzothiazol-2-yl)-2-[2-oxo-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethoxy]phenyl]methyl-dimethyl-ammonium CAS Name: [5-(1,3-benzothiazol-2-yl)-2-[2-oxo-2-[[(2R)-2-oxolanyl]methylamino]ethoxy]phenyl]methyl-dimethylammonium IUPAC Name: [5-(1,3-benzothiazol-2-yl)-2-[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethoxy]phenyl]methyl-dimethylazanium Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-[2-keto-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethoxy]benzyl]-dimethyl-ammonium Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OCC(=O)NCC4CCCO4

Isomeric SMILES

C[NH+](C)CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OCC(=O)NC[C@H]4CCCO4

InChI

InChI=1S/C23H27N3O3S/c1-26(2)14-17-12-16(23-25-19-7-3-4-8-21(19)30-23)9-10-20(17)29-15-22(27)24-13-18-6-5-11-28-18/h3-4,7-10,12,18H,5-6,11,13-15H2,1-2H3,(H,24,27)/p+1/t18-/m1/s1