8-oxidanylidene-8-phenanthren-9-yl-octanoic acid

Systemtic Name: 8-oxidanylidene-8-phenanthren-9-yl-octanoic acid Openeye Name: 8-oxo-8-(9-phenanthryl)octanoic acid CAS Name: 8-oxo-8-(9-phenanthrenyl)octanoic acid IUPAC Name: 8-oxo-8-phenanthren-9-yloctanoic acid Traditional Name: 8-keto-8-(9-phenanthryl)caprylic acid Formula: C22H22O3 MolecularWeight: 334.40828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C(=O)CCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C(=O)CCCCCCC(=O)O

InChI

InChI=1S/C22H22O3/c23-21(13-3-1-2-4-14-22(24)25)20-15-16-9-5-6-10-17(16)18-11-7-8-12-19(18)20/h5-12,15H,1-4,13-14H2,(H,24,25)