2-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyliminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyliminomethyl]-4-nitro-phenolate Openeye Name: 2-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyliminomethyl]-4-nitro-phenolate CAS Name: 2-[2-[(5-bromo-2-thiophenyl)methylthio]ethyliminomethyl]-4-nitrophenolate IUPAC Name: 2-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyliminomethyl]-4-nitrophenolate Traditional Name: 2-[2-[(5-bromo-2-thienyl)methylthio]ethyliminomethyl]-4-nitro-phenolate Formula: C14H12BrN2O3S2- MolecularWeight: 400.29068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C=NCCSCC2=CC=C(S2)Br)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C=NCCSCC2=CC=C(S2)Br)[O-]

InChI

InChI=1S/C14H13BrN2O3S2/c15-14-4-2-12(22-14)9-21-6-5-16-8-10-7-11(17(19)20)1-3-13(10)18/h1-4,7-8,18H,5-6,9H2/p-1