diethyl 2-[[(2-phenyl-3,4-dihydropyrazol-5-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(2-phenyl-3,4-dihydropyrazol-5-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(2-phenyl-3,4-dihydropyrazol-5-yl)amino]methylene]propanedioate CAS Name: 2-[[(2-phenyl-3,4-dihydropyrazol-5-yl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(2-phenyl-3,4-dihydropyrazol-5-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(1-phenyl-2-pyrazolin-3-yl)amino]methylene]malonic acid diethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NN(CC1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NN(CC1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C17H21N3O4/c1-3-23-16(21)14(17(22)24-4-2)12-18-15-10-11-20(19-15)13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,18,19)