[1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 2-(3-bromanyl-1-adamantyl)ethanoate

Systemtic Name: [1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 2-(3-bromanyl-1-adamantyl)ethanoate Openeye Name: [1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 2-(3-bromo-1-adamantyl)acetate CAS Name: 2-(3-bromo-1-adamantyl)acetic acid [1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 2-(3-bromo-1-adamantyl)acetate Traditional Name: 2-(3-bromo-1-adamantyl)acetic acid [2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl] ester Formula: C23H27BrN2O4 MolecularWeight: 475.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)OC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)OC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C23H27BrN2O4/c1-14(21(29)26-12-19(27)25-17-4-2-3-5-18(17)26)30-20(28)11-22-7-15-6-16(8-22)10-23(24,9-15)13-22/h2-5,14-16H,6-13H2,1H3,(H,25,27)