3-butan-2-yl-5-(3-chloranyl-4-methyl-phenyl)-1-(2-methylphenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-butan-2-yl-5-(3-chloranyl-4-methyl-phenyl)-1-(2-methylphenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(3-chloro-4-methyl-phenyl)-1-(o-tolyl)-4,6-dioxo-3-sec-butyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-butan-2-yl-5-(3-chloro-4-methylphenyl)-1-(2-methylphenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-butan-2-yl-5-(3-chloro-4-methylphenyl)-1-(2-methylphenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(3-chloro-4-methyl-phenyl)-4,6-diketo-1-(o-tolyl)-3-sec-butyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C25H27ClN2O4 MolecularWeight: 454.94588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(C2C(C(N1)C3=CC=CC=C3C)C(=O)N(C2=O)C4=CC(=C(C=C4)C)Cl)C(=O)O

Isomeric SMILES

CCC(C)C1(C2C(C(N1)C3=CC=CC=C3C)C(=O)N(C2=O)C4=CC(=C(C=C4)C)Cl)C(=O)O

InChI

InChI=1S/C25H27ClN2O4/c1-5-15(4)25(24(31)32)20-19(21(27-25)17-9-7-6-8-13(17)2)22(29)28(23(20)30)16-11-10-14(3)18(26)12-16/h6-12,15,19-21,27H,5H2,1-4H3,(H,31,32)