[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C18H14FNO3S MolecularWeight: 343.372063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)F

InChI

InChI=1S/C18H14FNO3S/c19-14-6-7-15-13(8-14)9-16(24-15)18(22)23-11-17(21)20-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,20,21)