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

Systemtic Name: N-(1-adamantyl)-4-(3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl)-2,4-bis(oxidanylidene)butanamide Openeye Name: N-(1-adamantyl)-4-(3-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-yl)-2,4-dioxo-butanamide CAS Name: N-(1-adamantyl)-4-(3-methyl-4-oxido-1-oxo-2-quinoxalin-1-iumyl)-2,4-dioxobutanamide IUPAC Name: N-(1-adamantyl)-4-(3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl)-2,4-dioxobutanamide Traditional Name: N-(1-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)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)CC(=O)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

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