4-chloranyl-N-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-chloro-N-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-propyl]benzamide CAS Name: 4-chloro-N-[3-[4-[(2-fluorophenyl)methyl]-1-piperazin-4-iumyl]-3-oxopropyl]benzamide IUPAC Name: 4-chloro-N-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxopropyl]benzamide Traditional Name: 4-chloro-N-[3-[4-(2-fluorobenzyl)piperazin-4-ium-1-yl]-3-keto-propyl]benzamide Formula: C21H24ClFN3O2+ MolecularWeight: 404.885563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)CCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)CCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClFN3O2/c22-18-7-5-16(6-8-18)21(28)24-10-9-20(27)26-13-11-25(12-14-26)15-17-3-1-2-4-19(17)23/h1-8H,9-15H2,(H,24,28)/p+1