methyl 4-[2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]ethyl]benzoate CAS Name: 4-[2-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]ethyl]benzoate Traditional Name: 4-[2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]ethyl]benzoic acid methyl ester Formula: C19H15ClFNO3S MolecularWeight: 391.843703

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C19H15ClFNO3S/c1-25-19(24)12-4-2-11(3-5-12)8-9-22-18(23)17-16(20)14-7-6-13(21)10-15(14)26-17/h2-7,10H,8-9H2,1H3,(H,22,23)