pyren-1-ylmethyl 2-methylprop-2-enoate

Systemtic Name: pyren-1-ylmethyl 2-methylprop-2-enoate Openeye Name: pyren-1-ylmethyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 1-pyrenylmethyl ester IUPAC Name: pyren-1-ylmethyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid pyren-1-ylmethyl ester Formula: C21H16O2 MolecularWeight: 300.35054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CC(=C)C(=O)OCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C21H16O2/c1-13(2)21(22)23-12-17-9-8-16-7-6-14-4-3-5-15-10-11-18(17)20(16)19(14)15/h3-11H,1,12H2,2H3