6-[(5-oxidanylidene-1-propyl-7,8-dihydro-6H-naphthalen-2-yl)oxy]hexyl 3-phenylpropanoate

Systemtic Name: 6-[(5-oxidanylidene-1-propyl-7,8-dihydro-6H-naphthalen-2-yl)oxy]hexyl 3-phenylpropanoate Openeye Name: 6-(1-oxo-5-propyl-tetralin-6-yl)oxyhexyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid 6-[(5-oxo-1-propyl-7,8-dihydro-6H-naphthalen-2-yl)oxy]hexyl ester IUPAC Name: 6-[(5-oxo-1-propyl-7,8-dihydro-6H-naphthalen-2-yl)oxy]hexyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid 6-(1-keto-5-propyl-tetralin-6-yl)oxyhexyl ester Formula: C28H36O4 MolecularWeight: 436.58304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1CCCC2=O)OCCCCCCOC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC2=C1CCCC2=O)OCCCCCCOC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C28H36O4/c1-2-11-25-23-14-10-15-26(29)24(23)17-18-27(25)31-20-8-3-4-9-21-32-28(30)19-16-22-12-6-5-7-13-22/h5-7,12-13,17-18H,2-4,8-11,14-16,19-21H2,1H3