2-(2-dodecoxyphenyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-(2-dodecoxyphenyl)pyrimidine-5-carboxylic acid Openeye Name: 2-(2-dodecoxyphenyl)pyrimidine-5-carboxylic acid CAS Name: 2-(2-dodecoxyphenyl)-5-pyrimidinecarboxylic acid IUPAC Name: 2-(2-dodecoxyphenyl)pyrimidine-5-carboxylic acid Traditional Name: 2-(2-lauryloxyphenyl)pyrimidine-5-carboxylic acid Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC=C1C2=NC=C(C=N2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC=C1C2=NC=C(C=N2)C(=O)O

InChI

InChI=1S/C23H32N2O3/c1-2-3-4-5-6-7-8-9-10-13-16-28-21-15-12-11-14-20(21)22-24-17-19(18-25-22)23(26)27/h11-12,14-15,17-18H,2-10,13,16H2,1H3,(H,26,27)