[2-[(2-chloranyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] 2-(3-fluoranylphenoxy)ethanoate

Systemtic Name: [2-[(2-chloranyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] 2-(3-fluoranylphenoxy)ethanoate Openeye Name: [2-(2-chloro-4-thiocyanato-anilino)-2-oxo-ethyl] 2-(3-fluorophenoxy)acetate CAS Name: 2-(3-fluorophenoxy)acetic acid [2-(2-chloro-4-thiocyanatoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-thiocyanatoanilino)-2-oxoethyl] 2-(3-fluorophenoxy)acetate Traditional Name: 2-(3-fluorophenoxy)acetic acid [2-(2-chloro-4-thiocyanato-anilino)-2-keto-ethyl] ester Formula: C17H12ClFN2O4S MolecularWeight: 394.804583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)OCC(=O)OCC(=O)NC2=C(C=C(C=C2)SC#N)Cl

Isomeric SMILES

C1=CC(=CC(=C1)F)OCC(=O)OCC(=O)NC2=C(C=C(C=C2)SC#N)Cl

InChI

InChI=1S/C17H12ClFN2O4S/c18-14-7-13(26-10-20)4-5-15(14)21-16(22)8-25-17(23)9-24-12-3-1-2-11(19)6-12/h1-7H,8-9H2,(H,21,22)