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1-undec-10-ynoyloxyhexyl 4-(4-nonoxyphenyl)benzoate

1-undec-10-ynoyloxyhexyl 4-(4-nonoxyphenyl)benzoate

Systemtic Name:1-undec-10-ynoyloxyhexyl 4-(4-nonoxyphenyl)benzoate
Openeye Name:1-undec-10-ynoyloxyhexyl 4-(4-nonoxyphenyl)benzoate
CAS Name:4-(4-nonoxyphenyl)benzoic acid 1-(1-oxoundec-10-ynoxy)hexyl ester
IUPAC Name:1-undec-10-ynoyloxyhexyl 4-(4-nonoxyphenyl)benzoate
Traditional Name:4-(4-nonoxyphenyl)benzoic acid 1-undec-10-ynoyloxyhexyl ester
Formula: C39H56O5
MolecularWeight: 604.85894
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(CCCCC)OC(=O)CCCCCCCCC#C


Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(CCCCC)OC(=O)CCCCCCCCC#C


InChI

InChI=1S/C39H56O5/c1-4-7-10-12-14-15-17-20-22-37(40)43-38(23-19-9-6-3)44-39(41)35-26-24-33(25-27-35)34-28-30-36(31-29-34)42-32-21-18-16-13-11-8-5-2/h1,24-31,38H,5-23,32H2,2-3H3


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