1-pyren-1-ylpropan-2-one

Systemtic Name: 1-pyren-1-ylpropan-2-one Openeye Name: 1-pyren-1-ylpropan-2-one CAS Name: 1-(1-pyrenyl)-2-propanone IUPAC Name: 1-pyren-1-ylpropan-2-one Traditional Name: 1-pyren-1-ylacetone Formula: C19H14O MolecularWeight: 258.31386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CC(=O)CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C19H14O/c1-12(20)11-16-8-7-15-6-5-13-3-2-4-14-9-10-17(16)19(15)18(13)14/h2-10H,11H2,1H3