3-[(4-aminocarbonylpiperidin-1-yl)methyl]-4-fluoranyl-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[(4-aminocarbonylpiperidin-1-yl)methyl]-4-fluoranyl-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(4-carbamoyl-1-piperidyl)methyl]-4-fluoro-benzothiophene-2-carboxylic acid CAS Name: 3-[(4-carbamoyl-1-piperidinyl)methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(4-carbamoylpiperidin-1-yl)methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(4-carbamoylpiperidino)methyl]-4-fluoro-benzothiophene-2-carboxylic acid Formula: C16H17FN2O3S MolecularWeight: 336.381183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC2=C(SC3=CC=CC(=C32)F)C(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)N)CC2=C(SC3=CC=CC(=C32)F)C(=O)O

InChI

InChI=1S/C16H17FN2O3S/c17-11-2-1-3-12-13(11)10(14(23-12)16(21)22)8-19-6-4-9(5-7-19)15(18)20/h1-3,9H,4-8H2,(H2,18,20)(H,21,22)