pyrene-1,4,5,10-tetracarboxylic acid

Systemtic Name: pyrene-1,4,5,10-tetracarboxylic acid Openeye Name: pyrene-1,4,5,10-tetracarboxylic acid CAS Name: pyrene-1,4,5,10-tetracarboxylic acid IUPAC Name: pyrene-1,4,5,10-tetracarboxylic acid Traditional Name: pyrene-1,4,5,10-tetracarboxylic acid Formula: C20H10O8 MolecularWeight: 378.2886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=C(C4=C3C(=C(C=C4)C(=O)O)C(=C2)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C3C(=C1)C(=C(C4=C3C(=C(C=C4)C(=O)O)C(=C2)C(=O)O)C(=O)O)C(=O)O

InChI

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