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2-(3,5-dimethylphenoxy)ethyl 1,3-benzothiazole-6-carboxylate

2-(3,5-dimethylphenoxy)ethyl 1,3-benzothiazole-6-carboxylate

Systemtic Name:2-(3,5-dimethylphenoxy)ethyl 1,3-benzothiazole-6-carboxylate
Openeye Name:2-(3,5-dimethylphenoxy)ethyl 1,3-benzothiazole-6-carboxylate
CAS Name:1,3-benzothiazole-6-carboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester
IUPAC Name:2-(3,5-dimethylphenoxy)ethyl 1,3-benzothiazole-6-carboxylate
Traditional Name:1,3-benzothiazole-6-carboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester
Formula: C18H17NO3S
MolecularWeight: 327.39748
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)C2=CC3=C(C=C2)N=CS3)C


Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)C2=CC3=C(C=C2)N=CS3)C


InChI

InChI=1S/C18H17NO3S/c1-12-7-13(2)9-15(8-12)21-5-6-22-18(20)14-3-4-16-17(10-14)23-11-19-16/h3-4,7-11H,5-6H2,1-2H3


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