N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: 2-(3-keto-1,4-benzoxazin-4-yl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Formula: C21H30N3O4+ MolecularWeight: 388.4806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CN2C(=O)COC3=CC=CC=C32)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CN2C(=O)COC3=CC=CC=C32)[NH+]4CCOCC4

InChI

InChI=1S/C21H29N3O4/c25-19(14-24-17-6-2-3-7-18(17)28-15-20(24)26)22-16-21(8-4-1-5-9-21)23-10-12-27-13-11-23/h2-3,6-7H,1,4-5,8-16H2,(H,22,25)/p+1