10-pyren-1-yldecanoate

Systemtic Name: 10-pyren-1-yldecanoate Openeye Name: 10-pyren-1-yldecanoate CAS Name: 10-(1-pyrenyl)decanoate IUPAC Name: 10-pyren-1-yldecanoate Traditional Name: 10-pyren-1-ylcaprate Formula: C26H27O2- MolecularWeight: 371.49138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCCCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCCCCCCCC(=O)[O-]

InChI

InChI=1S/C26H28O2/c27-24(28)12-7-5-3-1-2-4-6-9-19-13-14-22-16-15-20-10-8-11-21-17-18-23(19)26(22)25(20)21/h8,10-11,13-18H,1-7,9,12H2,(H,27,28)/p-1