[2-[[2-(2-adamantyl)-4,4-dimethyl-3-oxidanylidene-1,2-diazetidin-1-yl]carbonyl]phenyl] ethanoate

Systemtic Name: [2-[[2-(2-adamantyl)-4,4-dimethyl-3-oxidanylidene-1,2-diazetidin-1-yl]carbonyl]phenyl] ethanoate Openeye Name: [2-[2-(2-adamantyl)-4,4-dimethyl-3-oxo-diazetidine-1-carbonyl]phenyl] acetate CAS Name: acetic acid [2-[[2-(2-adamantyl)-4,4-dimethyl-3-oxo-1-diazetidinyl]-oxomethyl]phenyl] ester IUPAC Name: [2-[2-(2-adamantyl)-4,4-dimethyl-3-oxodiazetidine-1-carbonyl]phenyl] acetate Traditional Name: acetic acid [2-[2-(2-adamantyl)-3-keto-4,4-dimethyl-diazetidine-1-carbonyl]phenyl] ester Formula: C23H28N2O4 MolecularWeight: 396.47942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)N2C(C(=O)N2C3C4CC5CC(C4)CC3C5)(C)C

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)N2C(C(=O)N2C3C4CC5CC(C4)CC3C5)(C)C

InChI

InChI=1S/C23H28N2O4/c1-13(26)29-19-7-5-4-6-18(19)21(27)25-23(2,3)22(28)24(25)20-16-9-14-8-15(11-16)12-17(20)10-14/h4-7,14-17,20H,8-12H2,1-3H3