[4-(5-hexyl-1,3-thiazol-2-yl)phenyl] (E)-hex-2-enoate

Systemtic Name: [4-(5-hexyl-1,3-thiazol-2-yl)phenyl] (E)-hex-2-enoate Openeye Name: [4-(5-hexylthiazol-2-yl)phenyl] (E)-hex-2-enoate CAS Name: (E)-2-hexenoic acid [4-(5-hexyl-2-thiazolyl)phenyl] ester IUPAC Name: [4-(5-hexyl-1,3-thiazol-2-yl)phenyl] (E)-hex-2-enoate Traditional Name: (E)-hex-2-enoic acid [4-(5-hexylthiazol-2-yl)phenyl] ester Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(S1)C2=CC=C(C=C2)OC(=O)C=CCCC

Isomeric SMILES

CCCCCCC1=CN=C(S1)C2=CC=C(C=C2)OC(=O)/C=C/CCC

InChI

InChI=1S/C21H27NO2S/c1-3-5-7-9-10-19-16-22-21(25-19)17-12-14-18(15-13-17)24-20(23)11-8-6-4-2/h8,11-16H,3-7,9-10H2,1-2H3/b11-8+