2-adamantyl-[(2R)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium

Systemtic Name: 2-adamantyl-[(2R)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Openeye Name: 2-adamantyl-[(1R)-1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]ammonium CAS Name: 2-adamantyl-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]ammonium IUPAC Name: 2-adamantyl-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Traditional Name: 2-adamantyl-[(1R)-2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl]ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)[NH2+]C3C4CC5CC(C4)CC3C5

Isomeric SMILES

C[C@H](C(=O)N1CC(=O)NC2=CC=CC=C21)[NH2+]C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C21H27N3O2/c1-12(22-20-15-7-13-6-14(9-15)10-16(20)8-13)21(26)24-11-19(25)23-17-4-2-3-5-18(17)24/h2-5,12-16,20,22H,6-11H2,1H3,(H,23,25)/p+1/t12-,13?,14?,15?,16?,20?/m1/s1