ethyl (3E)-5-fluoranyl-3-[(4-phenylpiperazin-1-yl)hydrazinylidene]indole-2-carboxylate

Systemtic Name: ethyl (3E)-5-fluoranyl-3-[(4-phenylpiperazin-1-yl)hydrazinylidene]indole-2-carboxylate Openeye Name: ethyl (3E)-5-fluoro-3-[(4-phenylpiperazin-1-yl)hydrazono]indole-2-carboxylate CAS Name: (3E)-5-fluoro-3-[(4-phenyl-1-piperazinyl)hydrazinylidene]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl (3E)-5-fluoro-3-[(4-phenylpiperazin-1-yl)hydrazinylidene]indole-2-carboxylate Traditional Name: (3E)-5-fluoro-3-[(4-phenylpiperazino)hydrazono]indole-2-carboxylic acid ethyl ester Formula: C21H22FN5O2 MolecularWeight: 395.430083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C1=NNN3CCN(CC3)C4=CC=CC=C4)C=C(C=C2)F

Isomeric SMILES

CCOC(=O)C\1=NC2=C(/C1=N\NN3CCN(CC3)C4=CC=CC=C4)C=C(C=C2)F

InChI

InChI=1S/C21H22FN5O2/c1-2-29-21(28)20-19(17-14-15(22)8-9-18(17)23-20)24-25-27-12-10-26(11-13-27)16-6-4-3-5-7-16/h3-9,14,25H,2,10-13H2,1H3/b24-19+