2-[(5-chloranyl-2-nitro-phenyl)amino]ethyl thiocyanate

Systemtic Name: 2-[(5-chloranyl-2-nitro-phenyl)amino]ethyl thiocyanate Openeye Name: 2-(5-chloro-2-nitro-anilino)ethyl thiocyanate CAS Name: thiocyanic acid 2-(5-chloro-2-nitroanilino)ethyl ester IUPAC Name: 2-(5-chloro-2-nitroanilino)ethyl thiocyanate Traditional Name: thiocyanic acid 2-(5-chloro-2-nitro-anilino)ethyl ester Formula: C9H8ClN3O2S MolecularWeight: 257.69672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)NCCSC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Cl)NCCSC#N)[N+](=O)[O-]

InChI

InChI=1S/C9H8ClN3O2S/c10-7-1-2-9(13(14)15)8(5-7)12-3-4-16-6-11/h1-2,5,12H,3-4H2