[2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoate

Systemtic Name: [2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoate Openeye Name: [2-(3-fluorophenyl)-2-oxo-ethyl] 2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetate CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]acetic acid [2-(3-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-fluorophenyl)-2-oxoethyl] 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]acetate Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetic acid [2-(3-fluorophenyl)-2-keto-ethyl] ester Formula: C19H13ClFNO4S MolecularWeight: 405.827223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCC(=O)OCC(=O)C3=CC(=CC=C3)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCC(=O)OCC(=O)C3=CC(=CC=C3)F)Cl

InChI

InChI=1S/C19H13ClFNO4S/c20-17-13-6-1-2-7-15(13)27-18(17)19(25)22-9-16(24)26-10-14(23)11-4-3-5-12(21)8-11/h1-8H,9-10H2,(H,22,25)