methyl 2-[(4Z)-4-[1-(2-methylpropylamino)ethylidene]-5-oxidanylidene-1-phenyl-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(4Z)-4-[1-(2-methylpropylamino)ethylidene]-5-oxidanylidene-1-phenyl-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[(4Z)-4-[1-(isobutylamino)ethylidene]-5-oxo-1-phenyl-pyrazol-3-yl]acetate CAS Name: 2-[(4Z)-4-[1-(2-methylpropylamino)ethylidene]-5-oxo-1-phenyl-3-pyrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[(4Z)-4-[1-(2-methylpropylamino)ethylidene]-5-oxo-1-phenylpyrazol-3-yl]acetate Traditional Name: 2-[(4Z)-4-[1-(isobutylamino)ethylidene]-5-keto-1-phenyl-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)C

Isomeric SMILES

CC(C)CN/C(=C\1/C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)/C

InChI

InChI=1S/C18H23N3O3/c1-12(2)11-19-13(3)17-15(10-16(22)24-4)20-21(18(17)23)14-8-6-5-7-9-14/h5-9,12,19H,10-11H2,1-4H3/b17-13-