5-acetamido-N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazine-8-carboxamide

Systemtic Name: 5-acetamido-N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazine-8-carboxamide Openeye Name: 5-acetamido-6-chloro-3-oxo-N-quinuclidin-3-yl-4H-1,4-benzoxazine-8-carboxamide CAS Name: 5-acetamido-N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-3-oxo-4H-1,4-benzoxazine-8-carboxamide IUPAC Name: 5-acetamido-N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-3-oxo-4H-1,4-benzoxazine-8-carboxamide Traditional Name: 5-acetamido-6-chloro-3-keto-N-quinuclidin-3-yl-4H-1,4-benzoxazine-8-carboxamide Formula: C18H21ClN4O4 MolecularWeight: 392.83674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C2=C1NC(=O)CO2)C(=O)NC3CN4CCC3CC4)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C2=C1NC(=O)CO2)C(=O)NC3CN4CCC3CC4)Cl

InChI

InChI=1S/C18H21ClN4O4/c1-9(24)20-15-12(19)6-11(17-16(15)22-14(25)8-27-17)18(26)21-13-7-23-4-2-10(13)3-5-23/h6,10,13H,2-5,7-8H2,1H3,(H,20,24)(H,21,26)(H,22,25)