6-nitrochrysene-1,2-diol

Systemtic Name: 6-nitrochrysene-1,2-diol Openeye Name: 6-nitrochrysene-1,2-diol CAS Name: 6-nitrochrysene-1,2-diol IUPAC Name: 6-nitrochrysene-1,2-diol Traditional Name: 6-nitrochrysene-1,2-diol Formula: C18H11NO4 MolecularWeight: 305.28424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=C2[N+](=O)[O-])C4=C(C=C3)C(=C(C=C4)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=C2[N+](=O)[O-])C4=C(C=C3)C(=C(C=C4)O)O

InChI

InChI=1S/C18H11NO4/c20-17-8-7-12-14(18(17)21)6-5-11-10-3-1-2-4-13(10)16(19(22)23)9-15(11)12/h1-9,20-21H