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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2,4,5-trimethoxybenzoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid 4-phthalimidobutyl ester Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O)OC)OC

InChI

InChI=1S/C22H23NO7/c1-27-17-13-19(29-3)18(28-2)12-16(17)22(26)30-11-7-6-10-23-20(24)14-8-4-5-9-15(14)21(23)25/h4-5,8-9,12-13H,6-7,10-11H2,1-3H3