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5-(3,4-dicyanophenyl)pentanoic acid

5-(3,4-dicyanophenyl)pentanoic acid

Systemtic Name:5-(3,4-dicyanophenyl)pentanoic acid
Openeye Name:5-(3,4-dicyanophenyl)pentanoic acid
CAS Name:5-(3,4-dicyanophenyl)pentanoic acid
IUPAC Name:5-(3,4-dicyanophenyl)pentanoic acid
Traditional Name:5-(3,4-dicyanophenyl)valeric acid
Formula: C13H12N2O2
MolecularWeight: 228.24658
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCCCC(=O)O)C#N)C#N


Isomeric SMILES

C1=CC(=C(C=C1CCCCC(=O)O)C#N)C#N


InChI

InChI=1S/C13H12N2O2/c14-8-11-6-5-10(7-12(11)9-15)3-1-2-4-13(16)17/h5-7H,1-4H2,(H,16,17)


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