ethyl 1-[[(3E)-3-[(2-fluorophenyl)hydrazinylidene]-2-oxidanylidene-indol-1-yl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[[(3E)-3-[(2-fluorophenyl)hydrazinylidene]-2-oxidanylidene-indol-1-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[[(3E)-3-[(2-fluorophenyl)hydrazono]-2-oxo-indolin-1-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[(3E)-3-[(2-fluorophenyl)hydrazinylidene]-2-oxo-1-indolyl]methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[(3E)-3-[(2-fluorophenyl)hydrazinylidene]-2-oxoindol-1-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[(3E)-3-[(2-fluorophenyl)hydrazono]-2-keto-indolin-1-yl]methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C23H26FN4O3+ MolecularWeight: 425.475943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CN2C3=CC=CC=C3C(=NNC4=CC=CC=C4F)C2=O

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CN2C3=CC=CC=C3/C(=N\NC4=CC=CC=C4F)/C2=O

InChI

InChI=1S/C23H25FN4O3/c1-2-31-23(30)16-11-13-27(14-12-16)15-28-20-10-6-3-7-17(20)21(22(28)29)26-25-19-9-5-4-8-18(19)24/h3-10,16,25H,2,11-15H2,1H3/p+1/b26-21+