4-bromanyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]benzamide Openeye Name: 4-bromo-N-[2-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]benzamide CAS Name: 4-bromo-N-[2-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]benzamide IUPAC Name: 4-bromo-N-[2-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]benzamide Traditional Name: 4-bromo-N-[2-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]benzamide Formula: C20H23BrN3O2+ MolecularWeight: 417.31952

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O2/c1-2-23-11-13-24(14-12-23)20(26)17-5-3-4-6-18(17)22-19(25)15-7-9-16(21)10-8-15/h3-10H,2,11-14H2,1H3,(H,22,25)/p+1