N-(1-azoniabicyclo[2.2.2]octan-4-yl)-6-chloranyl-4-methyl-3-oxidanylidene-1,4-benzoxazine-8-carboxamide

Systemtic Name: N-(1-azoniabicyclo[2.2.2]octan-4-yl)-6-chloranyl-4-methyl-3-oxidanylidene-1,4-benzoxazine-8-carboxamide Openeye Name: 6-chloro-4-methyl-3-oxo-N-quinuclidin-1-ium-4-yl-1,4-benzoxazine-8-carboxamide CAS Name: N-(1-azoniabicyclo[2.2.2]octan-4-yl)-6-chloro-4-methyl-3-oxo-1,4-benzoxazine-8-carboxamide IUPAC Name: N-(1-azoniabicyclo[2.2.2]octan-4-yl)-6-chloro-4-methyl-3-oxo-1,4-benzoxazine-8-carboxamide Traditional Name: 6-chloro-3-keto-4-methyl-N-quinuclidin-1-ium-4-yl-1,4-benzoxazine-8-carboxamide Formula: C17H21ClN3O3+ MolecularWeight: 350.81994

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=C(C=C2C(=O)NC34CC[NH+](CC3)CC4)Cl

Isomeric SMILES

CN1C(=O)COC2=C1C=C(C=C2C(=O)NC34CC[NH+](CC3)CC4)Cl

InChI

InChI=1S/C17H20ClN3O3/c1-20-13-9-11(18)8-12(15(13)24-10-14(20)22)16(23)19-17-2-5-21(6-3-17)7-4-17/h8-9H,2-7,10H2,1H3,(H,19,23)/p+1