2-[2,3-bis(oxidanyl)propyl]-6-nitro-5-oxidanyl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[2,3-bis(oxidanyl)propyl]-6-nitro-5-oxidanyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2,3-dihydroxypropyl)-5-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2,3-dihydroxypropyl)-5-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2,3-dihydroxypropyl)-5-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-glyceryl-5-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C15H12N2O7 MolecularWeight: 332.26498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])O)CC(CO)O

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])O)CC(CO)O

InChI

InChI=1S/C15H12N2O7/c18-6-7(19)5-16-14(21)9-3-1-2-8-12(9)10(15(16)22)4-11(20)13(8)17(23)24/h1-4,7,18-20H,5-6H2