N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-2,3-dihydro-1,4-dioxine-5-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-2,3-dihydro-1,4-dioxine-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-2,3-dihydro-1,4-dioxine-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[3-(4-morpholin-4-iumyl)propyl]-2,3-dihydro-1,4-dioxin-5-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-2,3-dihydro-1,4-dioxine-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-2,3-dihydro-p-dioxin-5-carboxamide Formula: C19H24N3O4S+ MolecularWeight: 390.47656

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN(C2=NC3=CC=CC=C3S2)C(=O)C4=COCCO4

Isomeric SMILES

C1COCC[NH+]1CCCN(C2=NC3=CC=CC=C3S2)C(=O)C4=COCCO4

InChI

InChI=1S/C19H23N3O4S/c23-18(16-14-25-12-13-26-16)22(7-3-6-21-8-10-24-11-9-21)19-20-15-4-1-2-5-17(15)27-19/h1-2,4-5,14H,3,6-13H2/p+1