5-(2,6-diethylphenyl)-3-methyl-4,6-bis(oxidanylidene)-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 5-(2,6-diethylphenyl)-3-methyl-4,6-bis(oxidanylidene)-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(2,6-diethylphenyl)-3-methyl-4,6-dioxo-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(2,6-diethylphenyl)-3-methyl-4,6-dioxo-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(2,6-diethylphenyl)-3-methyl-4,6-dioxo-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(2,6-diethylphenyl)-4,6-diketo-3-methyl-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=C(C=CC=C4CC)CC)C(N2)(C)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=C(C=CC=C4CC)CC)C(N2)(C)C(=O)O

InChI

InChI=1S/C27H32N2O5/c1-5-15-34-19-13-11-18(12-14-19)22-20-21(27(4,28-22)26(32)33)25(31)29(24(20)30)23-16(6-2)9-8-10-17(23)7-3/h8-14,20-22,28H,5-7,15H2,1-4H3,(H,32,33)