5-(3-tert-butyl-4-methoxy-phenyl)thiophene-2-carboxylate

Systemtic Name: 5-(3-tert-butyl-4-methoxy-phenyl)thiophene-2-carboxylate Openeye Name: 5-(3-tert-butyl-4-methoxy-phenyl)thiophene-2-carboxylate CAS Name: 5-(3-tert-butyl-4-methoxyphenyl)-2-thiophenecarboxylate IUPAC Name: 5-(3-tert-butyl-4-methoxyphenyl)thiophene-2-carboxylate Traditional Name: 5-(3-tert-butyl-4-methoxy-phenyl)-2-thenoate Formula: C16H17O3S- MolecularWeight: 289.36938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O3S/c1-16(2,3)11-9-10(5-6-12(11)19-4)13-7-8-14(20-13)15(17)18/h5-9H,1-4H3,(H,17,18)/p-1