1-adamantyl-[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)ethyl]ammonium Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)C[NH2+]C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)C[NH2+]C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C22H29N3O2/c1-21(2)20(27)24-17-5-3-4-6-18(17)25(21)19(26)13-23-22-10-14-7-15(11-22)9-16(8-14)12-22/h3-6,14-16,23H,7-13H2,1-2H3,(H,24,27)/p+1