[4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] nonanoate

Systemtic Name: [4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] nonanoate Openeye Name: [4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] nonanoate CAS Name: nonanoic acid [4-[2-(4-hexylphenyl)-5-thiazolyl]phenyl] ester IUPAC Name: [4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] nonanoate Traditional Name: pelargonic acid [4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] ester Formula: C30H39NO2S MolecularWeight: 477.70116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CN=C(S2)C3=CC=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CN=C(S2)C3=CC=C(C=C3)CCCCCC

InChI

InChI=1S/C30H39NO2S/c1-3-5-7-9-10-12-14-29(32)33-27-21-19-25(20-22-27)28-23-31-30(34-28)26-17-15-24(16-18-26)13-11-8-6-4-2/h15-23H,3-14H2,1-2H3