4-[[3-(1-adamantyl)-4a,5,8,8a-tetrahydronaphthalen-2-yl]oxy]butyl ethanoate

Systemtic Name: 4-[[3-(1-adamantyl)-4a,5,8,8a-tetrahydronaphthalen-2-yl]oxy]butyl ethanoate Openeye Name: 4-[[3-(1-adamantyl)-4a,5,8,8a-tetrahydronaphthalen-2-yl]oxy]butyl acetate CAS Name: acetic acid 4-[[3-(1-adamantyl)-4a,5,8,8a-tetrahydronaphthalen-2-yl]oxy]butyl ester IUPAC Name: 4-[[3-(1-adamantyl)-4a,5,8,8a-tetrahydronaphthalen-2-yl]oxy]butyl acetate Traditional Name: acetic acid 4-[[3-(1-adamantyl)-4a,5,8,8a-tetrahydronaphthalen-2-yl]oxy]butyl ester Formula: C26H36O3 MolecularWeight: 396.56224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCOC1=CC2CC=CCC2C=C1C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(=O)OCCCCOC1=CC2CC=CCC2C=C1C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H36O3/c1-18(27)28-8-4-5-9-29-25-14-23-7-3-2-6-22(23)13-24(25)26-15-19-10-20(16-26)12-21(11-19)17-26/h2-3,13-14,19-23H,4-12,15-17H2,1H3