4-(2,3-dihydro-1-benzothiophen-2-ylcarbonylamino)butanoic acid

Systemtic Name: 4-(2,3-dihydro-1-benzothiophen-2-ylcarbonylamino)butanoic acid Openeye Name: 4-(2,3-dihydrobenzothiophene-2-carbonylamino)butanoic acid CAS Name: 4-[[2,3-dihydro-1-benzothiophen-2-yl(oxo)methyl]amino]butanoic acid IUPAC Name: 4-(2,3-dihydro-1-benzothiophene-2-carbonylamino)butanoic acid Traditional Name: 4-(2,3-dihydrobenzothiophene-2-carbonylamino)butyric acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C21)C(=O)NCCCC(=O)O

Isomeric SMILES

C1C(SC2=CC=CC=C21)C(=O)NCCCC(=O)O

InChI

InChI=1S/C13H15NO3S/c15-12(16)6-3-7-14-13(17)11-8-9-4-1-2-5-10(9)18-11/h1-2,4-5,11H,3,6-8H2,(H,14,17)(H,15,16)