4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 3-phenyl-2,1-benzoxazole-5-carboxylate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 3-phenyl-2,1-benzoxazole-5-carboxylate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 3-phenyl-2,1-benzoxazole-5-carboxylate CAS Name: 3-phenyl-2,1-benzoxazole-5-carboxylic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 3-phenyl-2,1-benzoxazole-5-carboxylate Traditional Name: 3-phenylanthranil-5-carboxylic acid 4-phthalimidobutyl ester Formula: C26H20N2O5 MolecularWeight: 440.4474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)OCCCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)OCCCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H20N2O5/c29-24-19-10-4-5-11-20(19)25(30)28(24)14-6-7-15-32-26(31)18-12-13-22-21(16-18)23(33-27-22)17-8-2-1-3-9-17/h1-5,8-13,16H,6-7,14-15H2