prop-2-enyl 2-cyano-3-pyren-2-yl-2-(pyren-2-ylmethyl)propanoate

Systemtic Name: prop-2-enyl 2-cyano-3-pyren-2-yl-2-(pyren-2-ylmethyl)propanoate Openeye Name: allyl 2-cyano-3-pyren-2-yl-2-(pyren-2-ylmethyl)propanoate CAS Name: 2-cyano-3-(2-pyrenyl)-2-(2-pyrenylmethyl)propanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-cyano-3-pyren-2-yl-2-(pyren-2-ylmethyl)propanoate Traditional Name: 2-cyano-3-pyren-2-yl-2-(pyren-2-ylmethyl)propionic acid allyl ester Formula: C40H27NO2 MolecularWeight: 553.64788

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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#N

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#N

InChI

InChI=1S/C40H27NO2/c1-2-17-43-39(42)40(24-41,22-25-18-31-13-9-27-5-3-6-28-10-14-32(19-25)37(31)35(27)28)23-26-20-33-15-11-29-7-4-8-30-12-16-34(21-26)38(33)36(29)30/h2-16,18-21H,1,17,22-23H2