(3S)-3-(1,3-benzodioxol-5-ylmethyl)-1-(2-tert-butylphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-(1,3-benzodioxol-5-ylmethyl)-1-(2-tert-butylphenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-(1,3-benzodioxol-5-ylmethyl)-1-(2-tert-butylphenyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-(1,3-benzodioxol-5-ylmethyl)-1-(2-tert-butylphenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-(1,3-benzodioxol-5-ylmethyl)-1-(2-tert-butylphenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-1-(2-tert-butylphenyl)-3-piperonyl-pyrrolidine-2,5-quinone Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1N2C(=O)CC(C2=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1N2C(=O)C[C@@H](C2=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H23NO4/c1-22(2,3)16-6-4-5-7-17(16)23-20(24)12-15(21(23)25)10-14-8-9-18-19(11-14)27-13-26-18/h4-9,11,15H,10,12-13H2,1-3H3/t15-/m0/s1