5-(4-acetyloxyphenyl)-4-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanoic acid

Systemtic Name: 5-(4-acetyloxyphenyl)-4-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanoic acid Openeye Name: 5-(4-acetoxyphenyl)-4-(1,3-dioxoisoindolin-2-yl)pentanoic acid CAS Name: 5-(4-acetyloxyphenyl)-4-(1,3-dioxo-2-isoindolyl)pentanoic acid IUPAC Name: 5-(4-acetyloxyphenyl)-4-(1,3-dioxoisoindol-2-yl)pentanoic acid Traditional Name: 5-(4-acetoxyphenyl)-4-phthalimido-valeric acid Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)CC(CCC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)CC(CCC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H19NO6/c1-13(23)28-16-9-6-14(7-10-16)12-15(8-11-19(24)25)22-20(26)17-4-2-3-5-18(17)21(22)27/h2-7,9-10,15H,8,11-12H2,1H3,(H,24,25)