4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)benzoate

Systemtic Name: 4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)benzoate Openeye Name: 4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)benzoate CAS Name: 4-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]amino]benzoate IUPAC Name: 4-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)benzoate Traditional Name: 4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)benzoate Formula: C16H14NO3S- MolecularWeight: 300.35226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H15NO3S/c18-15(13-9-21-14-4-2-1-3-12(13)14)17-11-7-5-10(6-8-11)16(19)20/h5-9H,1-4H2,(H,17,18)(H,19,20)/p-1