2-(3-hexoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-(3-hexoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-(3-hexoxyphenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(3-hexoxyphenyl)-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-(3-hexoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(3-hexoxyphenyl)-4-methyl-thiazole-5-carboxylate Formula: C17H20NO3S- MolecularWeight: 318.4106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)C2=NC(=C(S2)C(=O)[O-])C

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)C2=NC(=C(S2)C(=O)[O-])C

InChI

InChI=1S/C17H21NO3S/c1-3-4-5-6-10-21-14-9-7-8-13(11-14)16-18-12(2)15(22-16)17(19)20/h7-9,11H,3-6,10H2,1-2H3,(H,19,20)/p-1