[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] thiocyanate

Systemtic Name: [2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] thiocyanate Openeye Name: [2-(2-methyl-4-nitro-anilino)-2-oxo-ethyl] thiocyanate CAS Name: thiocyanic acid [2-(2-methyl-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-4-nitroanilino)-2-oxoethyl] thiocyanate Traditional Name: thiocyanic acid [2-keto-2-(2-methyl-4-nitro-anilino)ethyl] ester Formula: C10H9N3O3S MolecularWeight: 251.26176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC#N

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC#N

InChI

InChI=1S/C10H9N3O3S/c1-7-4-8(13(15)16)2-3-9(7)12-10(14)5-17-6-11/h2-4H,5H2,1H3,(H,12,14)