N-(2-adamantyl)-4-(3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl)-2,4-bis(oxidanylidene)butanamide

Systemtic Name: N-(2-adamantyl)-4-(3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl)-2,4-bis(oxidanylidene)butanamide Openeye Name: N-(2-adamantyl)-4-(3-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-yl)-2,4-dioxo-butanamide CAS Name: N-(2-adamantyl)-4-(3-methyl-4-oxido-1-oxo-2-quinoxalin-1-iumyl)-2,4-dioxobutanamide IUPAC Name: N-(2-adamantyl)-4-(3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl)-2,4-dioxobutanamide Traditional Name: N-(2-adamantyl)-2,4-diketo-4-(1-keto-3-methyl-4-oxido-quinoxalin-1-ium-2-yl)butyramide Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)CC(=O)C(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)CC(=O)C(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C23H25N3O5/c1-12-22(26(31)18-5-3-2-4-17(18)25(12)30)19(27)11-20(28)23(29)24-21-15-7-13-6-14(9-15)10-16(21)8-13/h2-5,13-16,21H,6-11H2,1H3,(H,24,29)