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

Systemtic Name: 2,5-bis[1,3-bis(oxidanylidene)isoindol-2-yl]pentanoic acid hydrochloride Openeye Name: 2,5-bis(1,3-dioxoisoindolin-2-yl)pentanoic acid hydrochloride CAS Name: 2,5-bis(1,3-dioxo-2-isoindolyl)pentanoic acid hydrochloride IUPAC Name: 2,5-bis(1,3-dioxoisoindol-2-yl)pentanoic acid hydrochloride Traditional Name: 2,5-diphthalimidovaleric acid hydrochloride Formula: C21H17ClN2O6 MolecularWeight: 428.82248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(C(=O)O)N3C(=O)C4=CC=CC=C4C3=O.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(C(=O)O)N3C(=O)C4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C21H16N2O6.ClH/c24-17-12-6-1-2-7-13(12)18(25)22(17)11-5-10-16(21(28)29)23-19(26)14-8-3-4-9-15(14)20(23)27;/h1-4,6-9,16H,5,10-11H2,(H,28,29);1H