4-(5-dodecoxypyrazin-2-yl)benzoic acid

Systemtic Name: 4-(5-dodecoxypyrazin-2-yl)benzoic acid Openeye Name: 4-(5-dodecoxypyrazin-2-yl)benzoic acid CAS Name: 4-(5-dodecoxy-2-pyrazinyl)benzoic acid IUPAC Name: 4-(5-dodecoxypyrazin-2-yl)benzoic acid Traditional Name: 4-(5-lauryloxypyrazin-2-yl)benzoic acid Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=NC=C(N=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCOC1=NC=C(N=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C23H32N2O3/c1-2-3-4-5-6-7-8-9-10-11-16-28-22-18-24-21(17-25-22)19-12-14-20(15-13-19)23(26)27/h12-15,17-18H,2-11,16H2,1H3,(H,26,27)