methyl N-[(4E)-4-[[(2-ethylphenyl)amino]methylidene]-5-oxidanylidene-3-propyl-pyrazol-1-yl]carbamate

Systemtic Name: methyl N-[(4E)-4-[[(2-ethylphenyl)amino]methylidene]-5-oxidanylidene-3-propyl-pyrazol-1-yl]carbamate Openeye Name: methyl N-[(4E)-4-[(2-ethylanilino)methylene]-5-oxo-3-propyl-pyrazol-1-yl]carbamate CAS Name: N-[(4E)-4-[(2-ethylanilino)methylidene]-5-oxo-3-propyl-1-pyrazolyl]carbamic acid methyl ester IUPAC Name: methyl N-[(4E)-4-[(2-ethylanilino)methylidene]-5-oxo-3-propylpyrazol-1-yl]carbamate Traditional Name: N-[(4E)-4-[(2-ethylanilino)methylene]-5-keto-3-propyl-2-pyrazolin-1-yl]carbamic acid methyl ester Formula: C17H22N4O3 MolecularWeight: 330.38158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CNC2=CC=CC=C2CC)NC(=O)OC

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C/NC2=CC=CC=C2CC)NC(=O)OC

InChI

InChI=1S/C17H22N4O3/c1-4-8-15-13(16(22)21(19-15)20-17(23)24-3)11-18-14-10-7-6-9-12(14)5-2/h6-7,9-11,18H,4-5,8H2,1-3H3,(H,20,23)/b13-11+