pyrene-1,5,6,10-tetracarboxylic acid

Systemtic Name: pyrene-1,5,6,10-tetracarboxylic acid Openeye Name: pyrene-1,5,6,10-tetracarboxylic acid CAS Name: pyrene-1,5,6,10-tetracarboxylic acid IUPAC Name: pyrene-1,5,6,10-tetracarboxylic acid Traditional Name: pyrene-1,5,6,10-tetracarboxylic acid Formula: C20H10O8 MolecularWeight: 378.2886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=CC3=C4C2=C1C=C(C4=C(C=C3)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=CC3=C4C2=C1C=C(C4=C(C=C3)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C20H10O8/c21-17(22)9-3-1-7-5-11(19(25)26)16-10(18(23)24)4-2-8-6-12(20(27)28)15(9)13(7)14(8)16/h1-6H,(H,21,22)(H,23,24)(H,25,26)(H,27,28)