[bis[(2-chloranyl-6-fluoranyl-phenyl)methyl]amino] 4-chloranylbenzoate

Systemtic Name: [bis[(2-chloranyl-6-fluoranyl-phenyl)methyl]amino] 4-chloranylbenzoate Openeye Name: [bis[(2-chloro-6-fluoro-phenyl)methyl]amino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [bis[(2-chloro-6-fluorophenyl)methyl]amino] ester IUPAC Name: [bis[(2-chloro-6-fluorophenyl)methyl]amino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [bis(2-chloro-6-fluoro-benzyl)amino] ester Formula: C21H14Cl3F2NO2 MolecularWeight: 456.697166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN(CC2=C(C=CC=C2Cl)F)OC(=O)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN(CC2=C(C=CC=C2Cl)F)OC(=O)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C21H14Cl3F2NO2/c22-14-9-7-13(8-10-14)21(28)29-27(11-15-17(23)3-1-5-19(15)25)12-16-18(24)4-2-6-20(16)26/h1-10H,11-12H2