5-tert-butyl-3-methyl-4,6-bis(oxidanylidene)-1-[2,3,5-tris(chloranyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 5-tert-butyl-3-methyl-4,6-bis(oxidanylidene)-1-[2,3,5-tris(chloranyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-tert-butyl-3-methyl-4,6-dioxo-1-(2,3,5-trichlorophenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-tert-butyl-3-methyl-4,6-dioxo-1-(2,3,5-trichlorophenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-tert-butyl-3-methyl-4,6-dioxo-1-(2,3,5-trichlorophenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-tert-butyl-4,6-diketo-3-methyl-1-(2,3,5-trichlorophenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C18H19Cl3N2O4 MolecularWeight: 433.71346

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C(C(N1)C3=CC(=CC(=C3Cl)Cl)Cl)C(=O)N(C2=O)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1(C2C(C(N1)C3=CC(=CC(=C3Cl)Cl)Cl)C(=O)N(C2=O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C18H19Cl3N2O4/c1-17(2,3)23-14(24)10-11(15(23)25)18(4,16(26)27)22-13(10)8-5-7(19)6-9(20)12(8)21/h5-6,10-11,13,22H,1-4H3,(H,26,27)