2-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(2,3-dihydro-1,4-dioxin-5-ylcarbonyl)amino]ethyl-diethyl-azanium

Systemtic Name: 2-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(2,3-dihydro-1,4-dioxin-5-ylcarbonyl)amino]ethyl-diethyl-azanium Openeye Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(2,3-dihydro-1,4-dioxine-5-carbonyl)amino]ethyl-diethyl-ammonium CAS Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]amino]ethyl-diethylammonium IUPAC Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(2,3-dihydro-1,4-dioxine-5-carbonyl)amino]ethyl-diethylazanium Traditional Name: 2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(2,3-dihydro-p-dioxin-5-carbonyl)amino]ethyl-diethyl-ammonium Formula: C19H25ClN3O4S+ MolecularWeight: 426.9375

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)Cl)OC)C(=O)C3=COCCO3

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)Cl)OC)C(=O)C3=COCCO3

InChI

InChI=1S/C19H24ClN3O4S/c1-4-22(5-2)8-9-23(18(24)15-12-26-10-11-27-15)19-21-16-14(25-3)7-6-13(20)17(16)28-19/h6-7,12H,4-5,8-11H2,1-3H3/p+1