2-[3-(8-phenyloctyl)phenyl]oxirane-2-carboxylic acid

Systemtic Name: 2-[3-(8-phenyloctyl)phenyl]oxirane-2-carboxylic acid Openeye Name: 2-[3-(8-phenyloctyl)phenyl]oxirane-2-carboxylic acid CAS Name: 2-[3-(8-phenyloctyl)phenyl]-2-oxiranecarboxylic acid IUPAC Name: 2-[3-(8-phenyloctyl)phenyl]oxirane-2-carboxylic acid Traditional Name: 2-[3-(8-phenyloctyl)phenyl]oxirane-2-carboxylic acid Formula: C23H28O3 MolecularWeight: 352.46662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)(C2=CC(=CC=C2)CCCCCCCCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(O1)(C2=CC(=CC=C2)CCCCCCCCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H28O3/c24-22(25)23(18-26-23)21-16-10-15-20(17-21)14-7-4-2-1-3-6-11-19-12-8-5-9-13-19/h5,8-10,12-13,15-17H,1-4,6-7,11,14,18H2,(H,24,25)