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

Systemtic Name: 1-adamantylmethyl-[(2R)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Openeye Name: 1-adamantylmethyl-[(1R)-1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]ammonium CAS Name: 1-adamantylmethyl-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]ammonium IUPAC Name: 1-adamantylmethyl-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Traditional Name: 1-adamantylmethyl-[(1R)-2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl]ammonium Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)[NH2+]CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C(=O)N1CC(=O)NC2=CC=CC=C21)[NH2+]CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H29N3O2/c1-14(21(27)25-12-20(26)24-18-4-2-3-5-19(18)25)23-13-22-9-15-6-16(10-22)8-17(7-15)11-22/h2-5,14-17,23H,6-13H2,1H3,(H,24,26)/p+1/t14-,15?,16?,17?,22?/m1/s1