ethyl 2-(2-methanoylpyren-1-yl)oxyethanoate

Systemtic Name: ethyl 2-(2-methanoylpyren-1-yl)oxyethanoate Openeye Name: ethyl 2-(2-formylpyren-1-yl)oxyacetate CAS Name: 2-[(2-formyl-1-pyrenyl)oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-formylpyren-1-yl)oxyacetate Traditional Name: 2-(2-formylpyren-1-yl)oxyacetic acid ethyl ester Formula: C21H16O4 MolecularWeight: 332.34934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C2C=CC3=C4C2=C1C=CC4=CC=C3)C=O

Isomeric SMILES

CCOC(=O)COC1=C(C=C2C=CC3=C4C2=C1C=CC4=CC=C3)C=O

InChI

InChI=1S/C21H16O4/c1-2-24-18(23)12-25-21-16(11-22)10-15-7-6-13-4-3-5-14-8-9-17(21)20(15)19(13)14/h3-11H,2,12H2,1H3