[(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(4-bromanylpyrazol-1-yl)butanoate

Systemtic Name: [(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(4-bromanylpyrazol-1-yl)butanoate Openeye Name: [(Z)-[amino-(4-nitrophenyl)methylene]amino] 2-(4-bromopyrazol-1-yl)butanoate CAS Name: 2-(4-bromo-1-pyrazolyl)butanoic acid [(Z)-[amino-(4-nitrophenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(4-nitrophenyl)methylidene]amino] 2-(4-bromopyrazol-1-yl)butanoate Traditional Name: 2-(4-bromopyrazol-1-yl)butyric acid [(Z)-[amino-(4-nitrophenyl)methylene]amino] ester Formula: C14H14BrN5O4 MolecularWeight: 396.19606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)ON=C(C1=CC=C(C=C1)[N+](=O)[O-])N)N2C=C(C=N2)Br

Isomeric SMILES

CCC(C(=O)O/N=C(/C1=CC=C(C=C1)[N+](=O)[O-])\N)N2C=C(C=N2)Br

InChI

InChI=1S/C14H14BrN5O4/c1-2-12(19-8-10(15)7-17-19)14(21)24-18-13(16)9-3-5-11(6-4-9)20(22)23/h3-8,12H,2H2,1H3,(H2,16,18)