2-(2-adamantyl)-1-(1,3-benzodioxol-5-ylmethyl)-4,4-dimethyl-1,2-diazetidin-3-one

Systemtic Name: 2-(2-adamantyl)-1-(1,3-benzodioxol-5-ylmethyl)-4,4-dimethyl-1,2-diazetidin-3-one Openeye Name: 2-(2-adamantyl)-1-(1,3-benzodioxol-5-ylmethyl)-4,4-dimethyl-diazetidin-3-one CAS Name: 2-(2-adamantyl)-1-(1,3-benzodioxol-5-ylmethyl)-4,4-dimethyl-3-diazetidinone IUPAC Name: 2-(2-adamantyl)-1-(1,3-benzodioxol-5-ylmethyl)-4,4-dimethyldiazetidin-3-one Traditional Name: 2-(2-adamantyl)-4,4-dimethyl-1-piperonyl-diazetidin-3-one Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(N1CC2=CC3=C(C=C2)OCO3)C4C5CC6CC(C5)CC4C6)C

Isomeric SMILES

CC1(C(=O)N(N1CC2=CC3=C(C=C2)OCO3)C4C5CC6CC(C5)CC4C6)C

InChI

InChI=1S/C22H28N2O3/c1-22(2)21(25)24(20-16-6-14-5-15(8-16)9-17(20)7-14)23(22)11-13-3-4-18-19(10-13)27-12-26-18/h3-4,10,14-17,20H,5-9,11-12H2,1-2H3