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4-[(E)-non-1-enyl]-2-(4-undecylphenyl)benzoate

4-[(E)-non-1-enyl]-2-(4-undecylphenyl)benzoate

Systemtic Name:4-[(E)-non-1-enyl]-2-(4-undecylphenyl)benzoate
Openeye Name:4-[(E)-non-1-enyl]-2-(4-undecylphenyl)benzoate
CAS Name:4-[(E)-non-1-enyl]-2-(4-undecylphenyl)benzoate
IUPAC Name:4-[(E)-non-1-enyl]-2-(4-undecylphenyl)benzoate
Traditional Name:4-[(E)-non-1-enyl]-2-(4-undecylphenyl)benzoate
Formula: C33H47O2-
MolecularWeight: 475.72508
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(C=C1)C2=C(C=CC(=C2)C=CCCCCCCC)C(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCC1=CC=C(C=C1)C2=C(C=CC(=C2)/C=C/CCCCCCC)C(=O)[O-]


InChI

InChI=1S/C33H48O2/c1-3-5-7-9-11-12-14-15-17-19-28-21-24-30(25-22-28)32-27-29(23-26-31(32)33(34)35)20-18-16-13-10-8-6-4-2/h18,20-27H,3-17,19H2,1-2H3,(H,34,35)/p-1/b20-18+


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