triethyl pyrene-1,2,3-tricarboxylate

Systemtic Name: triethyl pyrene-1,2,3-tricarboxylate Openeye Name: triethyl pyrene-1,2,3-tricarboxylate CAS Name: pyrene-1,2,3-tricarboxylic acid triethyl ester IUPAC Name: triethyl pyrene-1,2,3-tricarboxylate Traditional Name: pyrene-1,2,3-tricarboxylic acid triethyl ester Formula: C25H22O6 MolecularWeight: 418.43858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2C=CC3=CC=CC4=C3C2=C1C=C4)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=C2C=CC3=CC=CC4=C3C2=C1C=C4)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C25H22O6/c1-4-29-23(26)20-16-12-10-14-8-7-9-15-11-13-17(19(16)18(14)15)21(24(27)30-5-2)22(20)25(28)31-6-3/h7-13H,4-6H2,1-3H3