4-methyl-2-[4-[(2,3,5-trimethylphenoxy)methyl]phenyl]-1,3-thiazole-5-carboxylate

Systemtic Name: 4-methyl-2-[4-[(2,3,5-trimethylphenoxy)methyl]phenyl]-1,3-thiazole-5-carboxylate Openeye Name: 4-methyl-2-[4-[(2,3,5-trimethylphenoxy)methyl]phenyl]thiazole-5-carboxylate CAS Name: 4-methyl-2-[4-[(2,3,5-trimethylphenoxy)methyl]phenyl]-5-thiazolecarboxylate IUPAC Name: 4-methyl-2-[4-[(2,3,5-trimethylphenoxy)methyl]phenyl]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[4-[(2,3,5-trimethylphenoxy)methyl]phenyl]thiazole-5-carboxylate Formula: C21H20NO3S- MolecularWeight: 366.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)[O-])C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)[O-])C)C)C

InChI

InChI=1S/C21H21NO3S/c1-12-9-13(2)14(3)18(10-12)25-11-16-5-7-17(8-6-16)20-22-15(4)19(26-20)21(23)24/h5-10H,11H2,1-4H3,(H,23,24)/p-1