2-(1-oxidanylundecyl)-1-(pyridin-2-ylamino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 2-(1-oxidanylundecyl)-1-(pyridin-2-ylamino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 2-(1-hydroxyundecyl)-1-(2-pyridylamino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 2-(1-hydroxyundecyl)-1-(2-pyridinylamino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 2-(1-hydroxyundecyl)-1-(pyridin-2-ylamino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 2-(1-hydroxyundecyl)-1-(2-pyridylamino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C23H34N4O3 MolecularWeight: 414.54106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C1C=CC2C(N1NC3=CC=CC=N3)C(=O)NC2=O)O

Isomeric SMILES

CCCCCCCCCCC(C1C=CC2C(N1NC3=CC=CC=N3)C(=O)NC2=O)O

InChI

InChI=1S/C23H34N4O3/c1-2-3-4-5-6-7-8-9-12-19(28)18-15-14-17-21(23(30)25-22(17)29)27(18)26-20-13-10-11-16-24-20/h10-11,13-19,21,28H,2-9,12H2,1H3,(H,24,26)(H,25,29,30)