10-oxidanylidene-10-pyren-1-yl-decanoate

Systemtic Name: 10-oxidanylidene-10-pyren-1-yl-decanoate Openeye Name: 10-oxo-10-pyren-1-yl-decanoate CAS Name: 10-oxo-10-(1-pyrenyl)decanoate IUPAC Name: 10-oxo-10-pyren-1-yldecanoate Traditional Name: 10-keto-10-pyren-1-yl-caprate Formula: C26H25O3- MolecularWeight: 385.4749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26O3/c27-23(10-5-3-1-2-4-6-11-24(28)29)21-16-14-20-13-12-18-8-7-9-19-15-17-22(21)26(20)25(18)19/h7-9,12-17H,1-6,10-11H2,(H,28,29)/p-1