(3-phenyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)methyl pentanoate

Systemtic Name: (3-phenyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)methyl pentanoate Openeye Name: (3-phenyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)methyl pentanoate CAS Name: pentanoic acid (3-phenyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)methyl ester IUPAC Name: (3-phenyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)methyl pentanoate Traditional Name: valeric acid (3-phenyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)methyl ester Formula: C19H22O2 MolecularWeight: 282.37678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC1=C(C2CC1C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)OCC1=C(C2CC1C=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H22O2/c1-2-3-9-18(20)21-13-17-15-10-11-16(12-15)19(17)14-7-5-4-6-8-14/h4-8,10-11,15-16H,2-3,9,12-13H2,1H3