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2-pyren-1-yldecanoic acid

2-pyren-1-yldecanoic acid

Systemtic Name:2-pyren-1-yldecanoic acid
Openeye Name:2-pyren-1-yldecanoic acid
CAS Name:2-(1-pyrenyl)decanoic acid
IUPAC Name:2-pyren-1-yldecanoic acid
Traditional Name:2-pyren-1-ylcapric acid
Formula: C26H28O2
MolecularWeight: 372.49932
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C26H28O2/c1-2-3-4-5-6-7-11-23(26(27)28)21-16-14-20-13-12-18-9-8-10-19-15-17-22(21)25(20)24(18)19/h8-10,12-17,23H,2-7,11H2,1H3,(H,27,28)


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