N-[(Z)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-[(Z)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-[(Z)-(2-chloro-6-fluoro-phenyl)methyleneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-[(Z)-(2-chloro-6-fluoro-benzylidene)amino]-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C20H23ClFN4O+ MolecularWeight: 389.874223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NN=CC2=C(C=CC=C2Cl)F)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)N/N=C\C2=C(C=CC=C2Cl)F)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClFN4O/c21-18-7-4-8-19(22)17(18)15-23-24-20(27)9-10-25-11-13-26(14-12-25)16-5-2-1-3-6-16/h1-8,15H,9-14H2,(H,24,27)/p+1/b23-15-