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4-[(E)-non-1-enyl]-2-(4-octylphenyl)benzoic acid

4-[(E)-non-1-enyl]-2-(4-octylphenyl)benzoic acid

Systemtic Name:4-[(E)-non-1-enyl]-2-(4-octylphenyl)benzoic acid
Openeye Name:4-[(E)-non-1-enyl]-2-(4-octylphenyl)benzoic acid
CAS Name:4-[(E)-non-1-enyl]-2-(4-octylphenyl)benzoic acid
IUPAC Name:4-[(E)-non-1-enyl]-2-(4-octylphenyl)benzoic acid
Traditional Name:4-[(E)-non-1-enyl]-2-(4-octylphenyl)benzoic acid
Formula: C30H42O2
MolecularWeight: 434.65328
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=C(C=CC(=C2)C=CCCCCCCC)C(=O)O


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=C(C=CC(=C2)/C=C/CCCCCCC)C(=O)O


InChI

InChI=1S/C30H42O2/c1-3-5-7-9-11-13-15-17-26-20-23-28(30(31)32)29(24-26)27-21-18-25(19-22-27)16-14-12-10-8-6-4-2/h15,17-24H,3-14,16H2,1-2H3,(H,31,32)/b17-15+


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