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4-[4-(4-octoxyphenyl)phenoxy]butan-2-yl heptanoate

4-[4-(4-octoxyphenyl)phenoxy]butan-2-yl heptanoate

Systemtic Name:4-[4-(4-octoxyphenyl)phenoxy]butan-2-yl heptanoate
Openeye Name:[1-methyl-3-[4-(4-octoxyphenyl)phenoxy]propyl] heptanoate
CAS Name:heptanoic acid 4-[4-(4-octoxyphenyl)phenoxy]butan-2-yl ester
IUPAC Name:4-[4-(4-octoxyphenyl)phenoxy]butan-2-yl heptanoate
Traditional Name:enanthic acid [1-methyl-3-[4-(4-octoxyphenyl)phenoxy]propyl] ester
Formula: C31H46O4
MolecularWeight: 482.69454
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCCC(C)OC(=O)CCCCCC


Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCCC(C)OC(=O)CCCCCC


InChI

InChI=1S/C31H46O4/c1-4-6-8-10-11-13-24-33-29-19-15-27(16-20-29)28-17-21-30(22-18-28)34-25-23-26(3)35-31(32)14-12-9-7-5-2/h15-22,26H,4-14,23-25H2,1-3H3


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