2-[2-[(2-fluorophenyl)methylsulfanyl]ethyliminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[2-[(2-fluorophenyl)methylsulfanyl]ethyliminomethyl]-4-nitro-phenolate Openeye Name: 2-[2-[(2-fluorophenyl)methylsulfanyl]ethyliminomethyl]-4-nitro-phenolate CAS Name: 2-[2-[(2-fluorophenyl)methylthio]ethyliminomethyl]-4-nitrophenolate IUPAC Name: 2-[2-[(2-fluorophenyl)methylsulfanyl]ethyliminomethyl]-4-nitrophenolate Traditional Name: 2-[2-[(2-fluorobenzyl)thio]ethyliminomethyl]-4-nitro-phenolate Formula: C16H14FN2O3S- MolecularWeight: 333.357363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])F

InChI

InChI=1S/C16H15FN2O3S/c17-15-4-2-1-3-12(15)11-23-8-7-18-10-13-9-14(19(21)22)5-6-16(13)20/h1-6,9-10,20H,7-8,11H2/p-1