ethyl 2-[(4Z)-4-[[(4-bromophenyl)amino]methylidene]-5-oxidanylidene-1H-pyrazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[(4Z)-4-[[(4-bromophenyl)amino]methylidene]-5-oxidanylidene-1H-pyrazol-3-yl]ethanoate Openeye Name: ethyl 2-[(4Z)-4-[(4-bromoanilino)methylene]-5-oxo-1H-pyrazol-3-yl]acetate CAS Name: 2-[(4Z)-4-[(4-bromoanilino)methylidene]-5-oxo-1H-pyrazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4Z)-4-[(4-bromoanilino)methylidene]-5-oxo-1H-pyrazol-3-yl]acetate Traditional Name: 2-[(4Z)-4-[(4-bromoanilino)methylene]-5-keto-2-pyrazolin-3-yl]acetic acid ethyl ester Formula: C14H14BrN3O3 MolecularWeight: 352.18326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NNC(=O)C1=CNC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)CC\1=NNC(=O)/C1=C\NC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H14BrN3O3/c1-2-21-13(19)7-12-11(14(20)18-17-12)8-16-10-5-3-9(15)4-6-10/h3-6,8,16H,2,7H2,1H3,(H,18,20)/b11-8-