[3-(1-adamantyl)-4-methoxy-phenyl] (2Z,4E,6E)-2-ethyl-3-methyl-octa-2,4,6-trienoate

Systemtic Name: [3-(1-adamantyl)-4-methoxy-phenyl] (2Z,4E,6E)-2-ethyl-3-methyl-octa-2,4,6-trienoate Openeye Name: [3-(1-adamantyl)-4-methoxy-phenyl] (2Z,4E,6E)-2-ethyl-3-methyl-octa-2,4,6-trienoate CAS Name: (2Z,4E,6E)-2-ethyl-3-methylocta-2,4,6-trienoic acid [3-(1-adamantyl)-4-methoxyphenyl] ester IUPAC Name: [3-(1-adamantyl)-4-methoxyphenyl] (2Z,4E,6E)-2-ethyl-3-methylocta-2,4,6-trienoate Traditional Name: (2Z,4E,6E)-2-ethyl-3-methyl-octa-2,4,6-trienoic acid [3-(1-adamantyl)-4-methoxy-phenyl] ester Formula: C28H36O3 MolecularWeight: 420.58364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36O3/c1-5-7-8-9-19(3)24(6-2)27(29)31-23-10-11-26(30-4)25(15-23)28-16-20-12-21(17-28)14-22(13-20)18-28/h5,7-11,15,20-22H,6,12-14,16-18H2,1-4H3/b7-5+,9-8+,24-19-