[4-(2-decyl-1,3-thiazol-5-yl)phenyl] heptanoate

Systemtic Name: [4-(2-decyl-1,3-thiazol-5-yl)phenyl] heptanoate Openeye Name: [4-(2-decylthiazol-5-yl)phenyl] heptanoate CAS Name: heptanoic acid [4-(2-decyl-5-thiazolyl)phenyl] ester IUPAC Name: [4-(2-decyl-1,3-thiazol-5-yl)phenyl] heptanoate Traditional Name: enanthic acid [4-(2-decylthiazol-5-yl)phenyl] ester Formula: C26H39NO2S MolecularWeight: 429.65836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=NC=C(S1)C2=CC=C(C=C2)OC(=O)CCCCCC

Isomeric SMILES

CCCCCCCCCCC1=NC=C(S1)C2=CC=C(C=C2)OC(=O)CCCCCC

InChI

InChI=1S/C26H39NO2S/c1-3-5-7-9-10-11-12-13-15-25-27-21-24(30-25)22-17-19-23(20-18-22)29-26(28)16-14-8-6-4-2/h17-21H,3-16H2,1-2H3