1-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-[2-(2-chloroanilino)-2-oxo-ethyl]-4-nitro-pyrazole-3-carboxamide CAS Name: 1-[2-(2-chloroanilino)-2-oxoethyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-[2-(2-chloroanilino)-2-oxoethyl]-4-nitropyrazole-3-carboxamide Traditional Name: 1-[2-(2-chloroanilino)-2-keto-ethyl]-4-nitro-pyrazole-3-carboxamide Formula: C12H10ClN5O4 MolecularWeight: 323.6919

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CN2C=C(C(=N2)C(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CN2C=C(C(=N2)C(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H10ClN5O4/c13-7-3-1-2-4-8(7)15-10(19)6-17-5-9(18(21)22)11(16-17)12(14)20/h1-5H,6H2,(H2,14,20)(H,15,19)