4,4-bis(4-hydroxyphenyl)-3a-methyl-isoindole-1,3-dione

Systemtic Name: 4,4-bis(4-hydroxyphenyl)-3a-methyl-isoindole-1,3-dione Openeye Name: 4,4-bis(4-hydroxyphenyl)-3a-methyl-isoindole-1,3-dione CAS Name: 4,4-bis(4-hydroxyphenyl)-3a-methylisoindole-1,3-dione IUPAC Name: 4,4-bis(4-hydroxyphenyl)-3a-methylisoindole-1,3-dione Traditional Name: 4,4-bis(4-hydroxyphenyl)-3a-methyl-isoindole-1,3-quinone Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(=CC=CC1(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O)C(=O)NC2=O

Isomeric SMILES

CC12C(=CC=CC1(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O)C(=O)NC2=O

InChI

InChI=1S/C21H17NO4/c1-20-17(18(25)22-19(20)26)3-2-12-21(20,13-4-8-15(23)9-5-13)14-6-10-16(24)11-7-14/h2-12,23-24H,1H3,(H,22,25,26)