3-[2,2-dimethyl-3-oxidanyl-4-(3-oxidanylidene-1H-isoindol-2-yl)-3,4-dihydrochromen-6-yl]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[2,2-dimethyl-3-oxidanyl-4-(3-oxidanylidene-1H-isoindol-2-yl)-3,4-dihydrochromen-6-yl]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[3-hydroxy-2,2-dimethyl-4-(1-oxoisoindolin-2-yl)chroman-6-yl]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione CAS Name: 3-[3-hydroxy-2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]-4-(1-pyrrolidinyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[3-hydroxy-2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)-3,4-dihydrochromen-6-yl]-4-pyrrolidin-1-ylcyclobut-3-ene-1,2-dione Traditional Name: 3-[3-hydroxy-4-(1-ketoisoindolin-2-yl)-2,2-dimethyl-chroman-6-yl]-4-pyrrolidino-cyclobut-3-ene-1,2-quinone Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C3=C(C(=O)C3=O)N4CCCC4)N5CC6=CC=CC=C6C5=O)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C3=C(C(=O)C3=O)N4CCCC4)N5CC6=CC=CC=C6C5=O)O)C

InChI

InChI=1S/C27H26N2O5/c1-27(2)25(32)21(29-14-16-7-3-4-8-17(16)26(29)33)18-13-15(9-10-19(18)34-27)20-22(24(31)23(20)30)28-11-5-6-12-28/h3-4,7-10,13,21,25,32H,5-6,11-12,14H2,1-2H3