5-(4-tridecylphenyl)pyrazine-2-carboxylic acid

Systemtic Name: 5-(4-tridecylphenyl)pyrazine-2-carboxylic acid Openeye Name: 5-(4-tridecylphenyl)pyrazine-2-carboxylic acid CAS Name: 5-(4-tridecylphenyl)-2-pyrazinecarboxylic acid IUPAC Name: 5-(4-tridecylphenyl)pyrazine-2-carboxylic acid Traditional Name: 5-(4-tridecylphenyl)pyrazinoic acid Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)O

InChI

InChI=1S/C24H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-14-16-21(17-15-20)22-18-26-23(19-25-22)24(27)28/h14-19H,2-13H2,1H3,(H,27,28)