diethyl 2-[[[5-(3-bromophenyl)-1H-pyrazol-3-yl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[5-(3-bromophenyl)-1H-pyrazol-3-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[5-(3-bromophenyl)-1H-pyrazol-3-yl]amino]methylene]propanedioate CAS Name: 2-[[[5-(3-bromophenyl)-1H-pyrazol-3-yl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[[5-(3-bromophenyl)-1H-pyrazol-3-yl]amino]methylidene]propanedioate Traditional Name: 2-[[[5-(3-bromophenyl)-1H-pyrazol-3-yl]amino]methylene]malonic acid diethyl ester Formula: C17H18BrN3O4 MolecularWeight: 408.24652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NNC(=C1)C2=CC(=CC=C2)Br)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NNC(=C1)C2=CC(=CC=C2)Br)C(=O)OCC

InChI

InChI=1S/C17H18BrN3O4/c1-3-24-16(22)13(17(23)25-4-2)10-19-15-9-14(20-21-15)11-6-5-7-12(18)8-11/h5-10H,3-4H2,1-2H3,(H2,19,20,21)