diethyl 4,5,9,10-tetrahydropyrene-4,9-dicarboxylate

Systemtic Name: diethyl 4,5,9,10-tetrahydropyrene-4,9-dicarboxylate Openeye Name: diethyl 4,5,9,10-tetrahydropyrene-4,9-dicarboxylate CAS Name: 4,5,9,10-tetrahydropyrene-4,9-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4,5,9,10-tetrahydropyrene-4,9-dicarboxylate Traditional Name: 4,5,9,10-tetrahydropyrene-4,9-dicarboxylic acid diethyl ester Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=C3C(=CC=C2)C(CC4=C3C1=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CC2=C3C(=CC=C2)C(CC4=C3C1=CC=C4)C(=O)OCC

InChI

InChI=1S/C22H22O4/c1-3-25-21(23)17-11-13-7-6-10-16-18(22(24)26-4-2)12-14-8-5-9-15(17)19(14)20(13)16/h5-10,17-18H,3-4,11-12H2,1-2H3