2-methyl-3,7-bis(oxidanyl)-8-phenyl-9aH-benzo[de]isoquinolin-2-ium-1,9-dione

Systemtic Name: 2-methyl-3,7-bis(oxidanyl)-8-phenyl-9aH-benzo[de]isoquinolin-2-ium-1,9-dione Openeye Name: 3,7-dihydroxy-2-methyl-8-phenyl-9aH-benzo[de]isoquinolin-2-ium-1,9-dione CAS Name: 3,7-dihydroxy-2-methyl-8-phenyl-9aH-benzo[de]isoquinolin-2-ium-1,9-dione IUPAC Name: 3,7-dihydroxy-2-methyl-8-phenyl-9aH-benzo[de]isoquinolin-2-ium-1,9-dione Traditional Name: 3,7-dihydroxy-2-methyl-8-phenyl-9aH-benzo[de]isoquinolin-2-ium-1,9-quinone Formula: C19H14NO4+ MolecularWeight: 320.31876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC=CC3=C2C(C1=O)C(=O)C(=C3O)C4=CC=CC=C4)O

Isomeric SMILES

C[N+]1=C(C2=CC=CC3=C2C(C1=O)C(=O)C(=C3O)C4=CC=CC=C4)O

InChI

InChI=1S/C19H13NO4/c1-20-18(23)12-9-5-8-11-14(12)15(19(20)24)17(22)13(16(11)21)10-6-3-2-4-7-10/h2-9,15H,1H3,(H,21,22)/p+1