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

Systemtic Name: 2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]ethyl 4-phenoxybenzoate Openeye Name: 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]ethyl 4-phenoxybenzoate CAS Name: 4-phenoxybenzoic acid 2-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]ethyl ester IUPAC Name: 2-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]ethyl 4-phenoxybenzoate Traditional Name: 4-phenoxybenzoic acid 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]ethyl ester Formula: C24H17ClFNO4S MolecularWeight: 469.912483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)OCCNC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)OCCNC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C24H17ClFNO4S/c25-21-19-11-8-16(26)14-20(19)32-22(21)23(28)27-12-13-30-24(29)15-6-9-18(10-7-15)31-17-4-2-1-3-5-17/h1-11,14H,12-13H2,(H,27,28)