2-[4-(2,3,6-trimethylphenoxy)phenyl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[4-(2,3,6-trimethylphenoxy)phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[4-(2,3,6-trimethylphenoxy)phenyl]thiazole-4-carboxylate CAS Name: 2-[4-(2,3,6-trimethylphenoxy)phenyl]-4-thiazolecarboxylate IUPAC Name: 2-[4-(2,3,6-trimethylphenoxy)phenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[4-(2,3,6-trimethylphenoxy)phenyl]thiazole-4-carboxylate Formula: C19H16NO3S- MolecularWeight: 338.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC2=CC=C(C=C2)C3=NC(=CS3)C(=O)[O-])C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC2=CC=C(C=C2)C3=NC(=CS3)C(=O)[O-])C

InChI

InChI=1S/C19H17NO3S/c1-11-4-5-12(2)17(13(11)3)23-15-8-6-14(7-9-15)18-20-16(10-24-18)19(21)22/h4-10H,1-3H3,(H,21,22)/p-1