(2-oxidanylidenecyclohexyl) 4-(1,3-thiazol-4-ylmethoxy)benzoate

Systemtic Name: (2-oxidanylidenecyclohexyl) 4-(1,3-thiazol-4-ylmethoxy)benzoate Openeye Name: (2-oxocyclohexyl) 4-(thiazol-4-ylmethoxy)benzoate CAS Name: 4-(4-thiazolylmethoxy)benzoic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 4-(1,3-thiazol-4-ylmethoxy)benzoate Traditional Name: 4-(thiazol-4-ylmethoxy)benzoic acid (2-ketocyclohexyl) ester Formula: C17H17NO4S MolecularWeight: 331.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=CC=C(C=C2)OCC3=CSC=N3

Isomeric SMILES

C1CCC(=O)C(C1)OC(=O)C2=CC=C(C=C2)OCC3=CSC=N3

InChI

InChI=1S/C17H17NO4S/c19-15-3-1-2-4-16(15)22-17(20)12-5-7-14(8-6-12)21-9-13-10-23-11-18-13/h5-8,10-11,16H,1-4,9H2