(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 3-chloro-6-fluoro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-fluoro-1-benzothiophene-2-carboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-fluoro-benzothiophene-2-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C17H11ClFNO3S MolecularWeight: 363.790543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C17H11ClFNO3S/c18-13-11-7-6-10(19)8-12(11)24-15(13)17(22)23-14(16(20)21)9-4-2-1-3-5-9/h1-8,14H,(H2,20,21)