(3,3-dimethyl-2-oxidanylidene-butyl) 4-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-(thiophene-2-carbonylamino)benzoate CAS Name: 4-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-(thiophene-2-carbonylamino)benzoate Traditional Name: 4-(2-thenoylamino)benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CS2

InChI

InChI=1S/C18H19NO4S/c1-18(2,3)15(20)11-23-17(22)12-6-8-13(9-7-12)19-16(21)14-5-4-10-24-14/h4-10H,11H2,1-3H3,(H,19,21)