cyclooctyl-[(2R)-1-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: cyclooctyl-[(2R)-1-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: cyclooctyl-[(1R)-2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-methyl-2-oxo-ethyl]ammonium CAS Name: cyclooctyl-[(2R)-1-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: cyclooctyl-[(2R)-1-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-oxopropan-2-yl]azanium Traditional Name: cyclooctyl-[(1R)-2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)-1-methyl-ethyl]ammonium Formula: C21H32N3O2+ MolecularWeight: 358.49768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)[NH2+]C3CCCCCCC3

Isomeric SMILES

C[C@H](C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)[NH2+]C3CCCCCCC3

InChI

InChI=1S/C21H31N3O2/c1-15(22-16-11-7-5-4-6-8-12-16)19(25)24-18-14-10-9-13-17(18)23-20(26)21(24,2)3/h9-10,13-16,22H,4-8,11-12H2,1-3H3,(H,23,26)/p+1/t15-/m1/s1