ethyl (E)-3-pyren-4-ylprop-2-enoate

Systemtic Name: ethyl (E)-3-pyren-4-ylprop-2-enoate Openeye Name: ethyl (E)-3-pyren-4-ylprop-2-enoate CAS Name: (E)-3-(4-pyrenyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-pyren-4-ylprop-2-enoate Traditional Name: (E)-3-pyren-4-ylacrylic acid ethyl ester Formula: C21H16O2 MolecularWeight: 300.35054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3

Isomeric SMILES

CCOC(=O)/C=C/C1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3

InChI

InChI=1S/C21H16O2/c1-2-23-19(22)12-11-16-13-17-7-3-5-14-9-10-15-6-4-8-18(16)21(15)20(14)17/h3-13H,2H2,1H3/b12-11+