4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2-(2-oxo-1,3-benzoxazol-3-yl)propanoate CAS Name: 2-(2-oxo-1,3-benzoxazol-3-yl)propanoic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2-(2-oxo-1,3-benzoxazol-3-yl)propanoate Traditional Name: 2-(2-keto-1,3-benzoxazol-3-yl)propionic acid 4-phthalimidobutyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCCCN1C(=O)C2=CC=CC=C2C1=O)N3C4=CC=CC=C4OC3=O

Isomeric SMILES

CC(C(=O)OCCCCN1C(=O)C2=CC=CC=C2C1=O)N3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H20N2O6/c1-14(24-17-10-4-5-11-18(17)30-22(24)28)21(27)29-13-7-6-12-23-19(25)15-8-2-3-9-16(15)20(23)26/h2-5,8-11,14H,6-7,12-13H2,1H3