ethyl (2E)-2-azanyl-2-[(4-chloranyl-2-nitro-5-pyrazol-1-yl-phenyl)hydrazinylidene]ethanoate

Systemtic Name: ethyl (2E)-2-azanyl-2-[(4-chloranyl-2-nitro-5-pyrazol-1-yl-phenyl)hydrazinylidene]ethanoate Openeye Name: ethyl (2E)-2-amino-2-[(4-chloro-2-nitro-5-pyrazol-1-yl-phenyl)hydrazono]acetate CAS Name: (2E)-2-amino-2-[[4-chloro-2-nitro-5-(1-pyrazolyl)phenyl]hydrazinylidene]acetic acid ethyl ester IUPAC Name: ethyl (2E)-2-amino-2-[(4-chloro-2-nitro-5-pyrazol-1-ylphenyl)hydrazinylidene]acetate Traditional Name: (2E)-2-amino-2-[(4-chloro-2-nitro-5-pyrazol-1-yl-phenyl)hydrazono]acetic acid ethyl ester Formula: C13H13ClN6O4 MolecularWeight: 352.73312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNC1=C(C=C(C(=C1)N2C=CC=N2)Cl)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)/C(=N\NC1=C(C=C(C(=C1)N2C=CC=N2)Cl)[N+](=O)[O-])/N

InChI

InChI=1S/C13H13ClN6O4/c1-2-24-13(21)12(15)18-17-9-7-10(19-5-3-4-16-19)8(14)6-11(9)20(22)23/h3-7,17H,2H2,1H3,(H2,15,18)