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

Systemtic Name: 2-(2-hydroxyethyl)-6-nitro-5-oxidanyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 5-hydroxy-2-(2-hydroxyethyl)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 5-hydroxy-2-(2-hydroxyethyl)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 5-hydroxy-2-(2-hydroxyethyl)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 5-hydroxy-2-(2-hydroxyethyl)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C14H10N2O6 MolecularWeight: 302.239

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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)CCO

Isomeric SMILES

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

InChI

InChI=1S/C14H10N2O6/c17-5-4-15-13(19)8-3-1-2-7-11(8)9(14(15)20)6-10(18)12(7)16(21)22/h1-3,6,17-18H,4-5H2