(4E)-4-[(2-methoxyphenyl)hydrazinylidene]-5-methyl-2-(piperidin-1-ium-1-ylmethyl)pyrazol-3-one

Systemtic Name: (4E)-4-[(2-methoxyphenyl)hydrazinylidene]-5-methyl-2-(piperidin-1-ium-1-ylmethyl)pyrazol-3-one Openeye Name: (4E)-4-[(2-methoxyphenyl)hydrazono]-5-methyl-2-(piperidin-1-ium-1-ylmethyl)pyrazol-3-one CAS Name: (4E)-4-[(2-methoxyphenyl)hydrazinylidene]-5-methyl-2-(1-piperidin-1-iumylmethyl)-3-pyrazolone IUPAC Name: (4E)-4-[(2-methoxyphenyl)hydrazinylidene]-5-methyl-2-(piperidin-1-ium-1-ylmethyl)pyrazol-3-one Traditional Name: (4E)-4-[(2-methoxyphenyl)hydrazono]-5-methyl-2-(piperidin-1-ium-1-ylmethyl)-2-pyrazolin-3-one Formula: C17H24N5O2+ MolecularWeight: 330.40476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=CC=C2OC)C[NH+]3CCCCC3

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=CC=CC=C2OC)C[NH+]3CCCCC3

InChI

InChI=1S/C17H23N5O2/c1-13-16(19-18-14-8-4-5-9-15(14)24-2)17(23)22(20-13)12-21-10-6-3-7-11-21/h4-5,8-9,18H,3,6-7,10-12H2,1-2H3/p+1/b19-16+