2-[7-[6-[bis(oxidanyl)methyl]pyridin-2-yl]heptyl]isoindole-1,3-dione

Systemtic Name: 2-[7-[6-[bis(oxidanyl)methyl]pyridin-2-yl]heptyl]isoindole-1,3-dione Openeye Name: 2-[7-[6-(dihydroxymethyl)-2-pyridyl]heptyl]isoindoline-1,3-dione CAS Name: 2-[7-[6-(dihydroxymethyl)-2-pyridinyl]heptyl]isoindole-1,3-dione IUPAC Name: 2-[7-[6-(dihydroxymethyl)pyridin-2-yl]heptyl]isoindole-1,3-dione Traditional Name: 2-[7-[6-(dihydroxymethyl)-2-pyridyl]heptyl]isoindoline-1,3-quinone Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCCCC3=NC(=CC=C3)C(O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCCCC3=NC(=CC=C3)C(O)O

InChI

InChI=1S/C21H24N2O4/c24-19-16-11-5-6-12-17(16)20(25)23(19)14-7-3-1-2-4-9-15-10-8-13-18(22-15)21(26)27/h5-6,8,10-13,21,26-27H,1-4,7,9,14H2