1-[(4-chloranyl-2-nitro-phenyl)amino]propan-2-yl thiocyanate

Systemtic Name: 1-[(4-chloranyl-2-nitro-phenyl)amino]propan-2-yl thiocyanate Openeye Name: [2-(4-chloro-2-nitro-anilino)-1-methyl-ethyl] thiocyanate CAS Name: thiocyanic acid 1-(4-chloro-2-nitroanilino)propan-2-yl ester IUPAC Name: 1-(4-chloro-2-nitroanilino)propan-2-yl thiocyanate Traditional Name: thiocyanic acid [2-(4-chloro-2-nitro-anilino)-1-methyl-ethyl] ester Formula: C10H10ClN3O2S MolecularWeight: 271.7233

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C=C(C=C1)Cl)[N+](=O)[O-])SC#N

Isomeric SMILES

CC(CNC1=C(C=C(C=C1)Cl)[N+](=O)[O-])SC#N

InChI

InChI=1S/C10H10ClN3O2S/c1-7(17-6-12)5-13-9-3-2-8(11)4-10(9)14(15)16/h2-4,7,13H,5H2,1H3