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2-butyl-3-[4-[(E)-pent-1-enyl]phenyl]benzoic acid

2-butyl-3-[4-[(E)-pent-1-enyl]phenyl]benzoic acid

Systemtic Name:2-butyl-3-[4-[(E)-pent-1-enyl]phenyl]benzoic acid
Openeye Name:2-butyl-3-[4-[(E)-pent-1-enyl]phenyl]benzoic acid
CAS Name:2-butyl-3-[4-[(E)-pent-1-enyl]phenyl]benzoic acid
IUPAC Name:2-butyl-3-[4-[(E)-pent-1-enyl]phenyl]benzoic acid
Traditional Name:2-butyl-3-[4-[(E)-pent-1-enyl]phenyl]benzoic acid
Formula: C22H26O2
MolecularWeight: 322.44064
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC=C1C(=O)O)C2=CC=C(C=C2)C=CCCC


Isomeric SMILES

CCCCC1=C(C=CC=C1C(=O)O)C2=CC=C(C=C2)/C=C/CCC


InChI

InChI=1S/C22H26O2/c1-3-5-7-9-17-13-15-18(16-14-17)19-11-8-12-21(22(23)24)20(19)10-6-4-2/h7-9,11-16H,3-6,10H2,1-2H3,(H,23,24)/b9-7+


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