1,2-dibutyl-9,10-bis(oxidanylidene)phenanthrene-3,6-dicarboxylate

Systemtic Name: 1,2-dibutyl-9,10-bis(oxidanylidene)phenanthrene-3,6-dicarboxylate Openeye Name: 1,2-dibutyl-9,10-dioxo-phenanthrene-3,6-dicarboxylate CAS Name: 1,2-dibutyl-9,10-dioxophenanthrene-3,6-dicarboxylate IUPAC Name: 1,2-dibutyl-9,10-dioxophenanthrene-3,6-dicarboxylate Traditional Name: 1,2-dibutyl-9,10-diketo-phenanthrene-3,6-dicarboxylate Formula: C24H22O6-2 MolecularWeight: 406.42788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C3=C(C=CC(=C3)C(=O)[O-])C(=O)C(=O)C2=C1CCCC)C(=O)[O-]

Isomeric SMILES

CCCCC1=C(C=C2C3=C(C=CC(=C3)C(=O)[O-])C(=O)C(=O)C2=C1CCCC)C(=O)[O-]

InChI

InChI=1S/C24H24O6/c1-3-5-7-14-15(8-6-4-2)20-18(12-19(14)24(29)30)17-11-13(23(27)28)9-10-16(17)21(25)22(20)26/h9-12H,3-8H2,1-2H3,(H,27,28)(H,29,30)/p-2