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

Systemtic Name: 5-(3-chloranyl-4-methyl-phenyl)-1-[2-(4-methoxyphenyl)ethenyl]-4,6-bis(oxidanylidene)-3-propan-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(3-chloro-4-methyl-phenyl)-3-isopropyl-1-[2-(4-methoxyphenyl)vinyl]-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(3-chloro-4-methylphenyl)-1-[2-(4-methoxyphenyl)ethenyl]-4,6-dioxo-3-propan-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(3-chloro-4-methylphenyl)-1-[2-(4-methoxyphenyl)ethenyl]-4,6-dioxo-3-propan-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(3-chloro-4-methyl-phenyl)-3-isopropyl-4,6-diketo-1-[2-(4-methoxyphenyl)vinyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C26H27ClN2O5 MolecularWeight: 482.95598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3C(NC(C3C2=O)(C(C)C)C(=O)O)C=CC4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3C(NC(C3C2=O)(C(C)C)C(=O)O)C=CC4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C26H27ClN2O5/c1-14(2)26(25(32)33)22-21(20(28-26)12-8-16-6-10-18(34-4)11-7-16)23(30)29(24(22)31)17-9-5-15(3)19(27)13-17/h5-14,20-22,28H,1-4H3,(H,32,33)