methyl 2-[4-[4-(4-hydroxyphenyl)-6-(4-oxidanylcyclohexyl)octan-2-yl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[4-(4-hydroxyphenyl)-6-(4-oxidanylcyclohexyl)octan-2-yl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[5-(4-hydroxycyclohexyl)-3-(4-hydroxyphenyl)-1-methyl-heptyl]phenoxy]acetate CAS Name: 2-[4-[6-(4-hydroxycyclohexyl)-4-(4-hydroxyphenyl)octan-2-yl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[6-(4-hydroxycyclohexyl)-4-(4-hydroxyphenyl)octan-2-yl]phenoxy]acetate Traditional Name: 2-[4-[5-(4-hydroxycyclohexyl)-3-(4-hydroxyphenyl)-1-methyl-heptyl]phenoxy]acetic acid methyl ester Formula: C29H40O5 MolecularWeight: 468.6249

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC(C)C1=CC=C(C=C1)OCC(=O)OC)C2=CC=C(C=C2)O)C3CCC(CC3)O

Isomeric SMILES

CCC(CC(CC(C)C1=CC=C(C=C1)OCC(=O)OC)C2=CC=C(C=C2)O)C3CCC(CC3)O

InChI

InChI=1S/C29H40O5/c1-4-21(23-5-11-26(30)12-6-23)18-25(24-7-13-27(31)14-8-24)17-20(2)22-9-15-28(16-10-22)34-19-29(32)33-3/h7-10,13-16,20-21,23,25-26,30-31H,4-6,11-12,17-19H2,1-3H3