3-methyl-2-[(E)-oct-2-en-2-yl]benzoic acid

Systemtic Name: 3-methyl-2-[(E)-oct-2-en-2-yl]benzoic acid Openeye Name: 3-methyl-2-[(E)-1-methylhept-1-enyl]benzoic acid CAS Name: 3-methyl-2-[(E)-oct-2-en-2-yl]benzoic acid IUPAC Name: 3-methyl-2-[(E)-oct-2-en-2-yl]benzoic acid Traditional Name: 3-methyl-2-[(E)-1-methylhept-1-enyl]benzoic acid Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=C(C)C1=C(C=CC=C1C)C(=O)O

Isomeric SMILES

CCCCC/C=C(\C)/C1=C(C=CC=C1C)C(=O)O

InChI

InChI=1S/C16H22O2/c1-4-5-6-7-9-12(2)15-13(3)10-8-11-14(15)16(17)18/h8-11H,4-7H2,1-3H3,(H,17,18)/b12-9+