(4-bromophenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (4-bromophenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(4-bromophenyl)methanone CAS Name: (4-bromophenyl)-(4-prop-2-enyl-1-piperazin-4-iumyl)methanone IUPAC Name: (4-bromophenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(4-bromophenyl)methanone Formula: C14H18BrN2O+ MolecularWeight: 310.20952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrN2O/c1-2-7-16-8-10-17(11-9-16)14(18)12-3-5-13(15)6-4-12/h2-6H,1,7-11H2/p+1