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4-methyl-2-[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]-1,3-thiazole-5-carboxylate
4-methyl-2-[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]-1,3-thiazole-5-carboxylate
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C(=C(C=C1)C)OCCOC2=CC=CC(=C2)C3=NC(=C(S3)C(=O)[O-])C)C
Isomeric SMILES
CC1=C(C(=C(C=C1)C)OCCOC2=CC=CC(=C2)C3=NC(=C(S3)C(=O)[O-])C)C
InChI
InChI=1S/C22H23NO4S/c1-13-8-9-14(2)19(15(13)3)27-11-10-26-18-7-5-6-17(12-18)21-23-16(4)20(28-21)22(24)25/h5-9,12H,10-11H2,1-4H3,(H,24,25)/p-1
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