methyl 4-(4-chloranylphenoxy)-2,3,5-tris(fluoranyl)-6-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 4-(4-chloranylphenoxy)-2,3,5-tris(fluoranyl)-6-pyrrolidin-1-yl-benzoate Openeye Name: methyl 4-(4-chlorophenoxy)-2,3,5-trifluoro-6-pyrrolidin-1-yl-benzoate CAS Name: 4-(4-chlorophenoxy)-2,3,5-trifluoro-6-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenoxy)-2,3,5-trifluoro-6-pyrrolidin-1-ylbenzoate Traditional Name: 4-(4-chlorophenoxy)-2,3,5-trifluoro-6-pyrrolidino-benzoic acid methyl ester Formula: C18H15ClF3NO3 MolecularWeight: 385.76481

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C(=C1F)F)OC2=CC=C(C=C2)Cl)F)N3CCCC3

Isomeric SMILES

COC(=O)C1=C(C(=C(C(=C1F)F)OC2=CC=C(C=C2)Cl)F)N3CCCC3

InChI

InChI=1S/C18H15ClF3NO3/c1-25-18(24)12-13(20)14(21)17(26-11-6-4-10(19)5-7-11)15(22)16(12)23-8-2-3-9-23/h4-7H,2-3,8-9H2,1H3