2-(2-adamantyl)-1-(1,3-benzodioxol-4-ylcarbonyl)-4,4-dimethyl-1,2-diazetidin-3-one

Systemtic Name: 2-(2-adamantyl)-1-(1,3-benzodioxol-4-ylcarbonyl)-4,4-dimethyl-1,2-diazetidin-3-one Openeye Name: 2-(2-adamantyl)-1-(1,3-benzodioxole-4-carbonyl)-4,4-dimethyl-diazetidin-3-one CAS Name: 2-(2-adamantyl)-1-[1,3-benzodioxol-4-yl(oxo)methyl]-4,4-dimethyl-3-diazetidinone IUPAC Name: 2-(2-adamantyl)-1-(1,3-benzodioxole-4-carbonyl)-4,4-dimethyldiazetidin-3-one Traditional Name: 2-(2-adamantyl)-1-(1,3-benzodioxole-4-carbonyl)-4,4-dimethyl-diazetidin-3-one Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(N1C(=O)C2=C3C(=CC=C2)OCO3)C4C5CC6CC(C5)CC4C6)C

Isomeric SMILES

CC1(C(=O)N(N1C(=O)C2=C3C(=CC=C2)OCO3)C4C5CC6CC(C5)CC4C6)C

InChI

InChI=1S/C22H26N2O4/c1-22(2)21(26)23(18-14-7-12-6-13(9-14)10-15(18)8-12)24(22)20(25)16-4-3-5-17-19(16)28-11-27-17/h3-5,12-15,18H,6-11H2,1-2H3