sodium 2-[[5-chloranyl-2-(cyclopentylmethoxy)phenyl]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: sodium 2-[[5-chloranyl-2-(cyclopentylmethoxy)phenyl]methyl]-1,3-thiazole-4-carboxylate Openeye Name: sodium 2-[[5-chloro-2-(cyclopentylmethoxy)phenyl]methyl]thiazole-4-carboxylate CAS Name: sodium 2-[[5-chloro-2-(cyclopentylmethoxy)phenyl]methyl]-4-thiazolecarboxylate IUPAC Name: sodium 2-[[5-chloro-2-(cyclopentylmethoxy)phenyl]methyl]-1,3-thiazole-4-carboxylate Traditional Name: sodium 2-[5-chloro-2-(cyclopentylmethoxy)benzyl]thiazole-4-carboxylate Formula: C17H17ClNNaO3S MolecularWeight: 373.82955

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)COC2=C(C=C(C=C2)Cl)CC3=NC(=CS3)C(=O)[O-].[Na+]

Isomeric SMILES

C1CCC(C1)COC2=C(C=C(C=C2)Cl)CC3=NC(=CS3)C(=O)[O-].[Na+]

InChI

InChI=1S/C17H18ClNO3S.Na/c18-13-5-6-15(22-9-11-3-1-2-4-11)12(7-13)8-16-19-14(10-23-16)17(20)21;/h5-7,10-11H,1-4,8-9H2,(H,20,21);/q;+1/p-1