3-[(E)-hex-1-enyl]-4-methyl-benzoic acid

Systemtic Name: 3-[(E)-hex-1-enyl]-4-methyl-benzoic acid Openeye Name: 3-[(E)-hex-1-enyl]-4-methyl-benzoic acid CAS Name: 3-[(E)-hex-1-enyl]-4-methylbenzoic acid IUPAC Name: 3-[(E)-hex-1-enyl]-4-methylbenzoic acid Traditional Name: 3-[(E)-hex-1-enyl]-4-methyl-benzoic acid Formula: C14H18O2 MolecularWeight: 218.29152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1=C(C=CC(=C1)C(=O)O)C

Isomeric SMILES

CCCC/C=C/C1=C(C=CC(=C1)C(=O)O)C

InChI

InChI=1S/C14H18O2/c1-3-4-5-6-7-12-10-13(14(15)16)9-8-11(12)2/h6-10H,3-5H2,1-2H3,(H,15,16)/b7-6+