4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 9,10-bis(oxidanylidene)anthracene-1-carboxylate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 9,10-bis(oxidanylidene)anthracene-1-carboxylate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 9,10-dioxoanthracene-1-carboxylate CAS Name: 9,10-dioxo-1-anthracenecarboxylic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 9,10-dioxoanthracene-1-carboxylate Traditional Name: 9,10-diketoanthracene-1-carboxylic acid 4-phthalimidobutyl ester Formula: C27H19NO6 MolecularWeight: 453.44286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCCCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCCCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H19NO6/c29-23-16-8-1-2-9-17(16)24(30)22-20(23)12-7-13-21(22)27(33)34-15-6-5-14-28-25(31)18-10-3-4-11-19(18)26(28)32/h1-4,7-13H,5-6,14-15H2