bis(prop-2-enyl) 2,2-bis(pyren-2-ylmethyl)propanedioate

Systemtic Name: bis(prop-2-enyl) 2,2-bis(pyren-2-ylmethyl)propanedioate Openeye Name: diallyl 2,2-bis(pyren-2-ylmethyl)propanedioate CAS Name: 2,2-bis(2-pyrenylmethyl)propanedioic acid bis(prop-2-enyl) ester IUPAC Name: bis(prop-2-enyl) 2,2-bis(pyren-2-ylmethyl)propanedioate Traditional Name: 2,2-bis(pyren-2-ylmethyl)malonic acid diallyl ester Formula: C43H32O4 MolecularWeight: 612.71178

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(CC1=CC2=C3C(=C1)C=CC4=C3C(=CC=C4)C=C2)(CC5=CC6=C7C(=C5)C=CC8=C7C(=CC=C8)C=C6)C(=O)OCC=C

Isomeric SMILES

C=CCOC(=O)C(CC1=CC2=C3C(=C1)C=CC4=C3C(=CC=C4)C=C2)(CC5=CC6=C7C(=C5)C=CC8=C7C(=CC=C8)C=C6)C(=O)OCC=C

InChI

InChI=1S/C43H32O4/c1-3-19-46-41(44)43(42(45)47-20-4-2,25-27-21-33-15-11-29-7-5-8-30-12-16-34(22-27)39(33)37(29)30)26-28-23-35-17-13-31-9-6-10-32-14-18-36(24-28)40(35)38(31)32/h3-18,21-24H,1-2,19-20,25-26H2