N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]ethylideneamino]-4-methyl-benzamide

Systemtic Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]ethylideneamino]-4-methyl-benzamide Openeye Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]ethylideneamino]-4-methyl-benzamide CAS Name: N-[(Z)-1-[4-(4-ethyl-1-piperazin-4-iumyl)-3-fluorophenyl]ethylideneamino]-4-methylbenzamide IUPAC Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluorophenyl]ethylideneamino]-4-methylbenzamide Traditional Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]ethylideneamino]-4-methyl-benzamide Formula: C22H28FN4O+ MolecularWeight: 383.482323

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=NNC(=O)C3=CC=C(C=C3)C)C)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)/C(=N\NC(=O)C3=CC=C(C=C3)C)/C)F

InChI

InChI=1S/C22H27FN4O/c1-4-26-11-13-27(14-12-26)21-10-9-19(15-20(21)23)17(3)24-25-22(28)18-7-5-16(2)6-8-18/h5-10,15H,4,11-14H2,1-3H3,(H,25,28)/p+1/b24-17-