oxolan-2-ylmethyl 4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)benzoate

Systemtic Name: oxolan-2-ylmethyl 4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)benzoate Openeye Name: tetrahydrofuran-2-ylmethyl 4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)benzoate CAS Name: 4-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]amino]benzoic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 4-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)benzoate Traditional Name: 4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)benzoic acid tetrahydrofurfuryl ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NC3=CC=C(C=C3)C(=O)OCC4CCCO4

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NC3=CC=C(C=C3)C(=O)OCC4CCCO4

InChI

InChI=1S/C21H23NO4S/c23-20(18-13-27-19-6-2-1-5-17(18)19)22-15-9-7-14(8-10-15)21(24)26-12-16-4-3-11-25-16/h7-10,13,16H,1-6,11-12H2,(H,22,23)