(5-bromanyl-2-chloranyl-phenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-bromanyl-2-chloranyl-phenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(5-bromo-2-chloro-phenyl)methanone CAS Name: (5-bromo-2-chlorophenyl)-(4-prop-2-enyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-bromo-2-chlorophenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(5-bromo-2-chloro-phenyl)methanone Formula: C14H17BrClN2O+ MolecularWeight: 344.65458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16BrClN2O/c1-2-5-17-6-8-18(9-7-17)14(19)12-10-11(15)3-4-13(12)16/h2-4,10H,1,5-9H2/p+1