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3-pyren-1-ylpropanoic acid

3-pyren-1-ylpropanoic acid

Systemtic Name:3-pyren-1-ylpropanoic acid
Openeye Name:3-pyren-1-ylpropanoic acid
CAS Name:3-(1-pyrenyl)propanoic acid
IUPAC Name:3-pyren-1-ylpropanoic acid
Traditional Name:3-pyren-1-ylpropionic acid
Formula: C19H14O2
MolecularWeight: 274.31326
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCC(=O)O


Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCC(=O)O


InChI

InChI=1S/C19H14O2/c20-17(21)11-9-12-4-5-15-7-6-13-2-1-3-14-8-10-16(12)19(15)18(13)14/h1-8,10H,9,11H2,(H,20,21)


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