(3-methoxyphenyl) (2E,4Z,6E)-4-(1-adamantyl)-3-methyl-octa-2,4,6-trienoate

Systemtic Name: (3-methoxyphenyl) (2E,4Z,6E)-4-(1-adamantyl)-3-methyl-octa-2,4,6-trienoate Openeye Name: (3-methoxyphenyl) (2E,4Z,6E)-4-(1-adamantyl)-3-methyl-octa-2,4,6-trienoate CAS Name: (2E,4Z,6E)-4-(1-adamantyl)-3-methylocta-2,4,6-trienoic acid (3-methoxyphenyl) ester IUPAC Name: (3-methoxyphenyl) (2E,4Z,6E)-4-(1-adamantyl)-3-methylocta-2,4,6-trienoate Traditional Name: (2E,4Z,6E)-4-(1-adamantyl)-3-methyl-octa-2,4,6-trienoic acid (3-methoxyphenyl) ester Formula: C26H32O3 MolecularWeight: 392.53048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC=C(C(=CC(=O)OC1=CC(=CC=C1)OC)C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C/C=C/C=C(\C(=C\C(=O)OC1=CC(=CC=C1)OC)\C)/C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C26H32O3/c1-4-5-9-24(26-15-19-11-20(16-26)13-21(12-19)17-26)18(2)10-25(27)29-23-8-6-7-22(14-23)28-3/h4-10,14,19-21H,11-13,15-17H2,1-3H3/b5-4+,18-10+,24-9+