(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C15H17NO3S/c1-9-12(10(2)19-16-9)8-18-15(17)14-7-11-5-3-4-6-13(11)20-14/h7H,3-6,8H2,1-2H3