4-(4-bromanyl-2-chloranyl-phenoxy)butyl-prop-2-enyl-azanium

Systemtic Name: 4-(4-bromanyl-2-chloranyl-phenoxy)butyl-prop-2-enyl-azanium Openeye Name: allyl-[4-(4-bromo-2-chloro-phenoxy)butyl]ammonium CAS Name: 4-(4-bromo-2-chlorophenoxy)butyl-prop-2-enylammonium IUPAC Name: 4-(4-bromo-2-chlorophenoxy)butyl-prop-2-enylazanium Traditional Name: allyl-[4-(4-bromo-2-chloro-phenoxy)butyl]ammonium Formula: C13H18BrClNO+ MolecularWeight: 319.64512

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH2+]CCCCOC1=C(C=C(C=C1)Br)Cl

Isomeric SMILES

C=CC[NH2+]CCCCOC1=C(C=C(C=C1)Br)Cl

InChI

InChI=1S/C13H17BrClNO/c1-2-7-16-8-3-4-9-17-13-6-5-11(14)10-12(13)15/h2,5-6,10,16H,1,3-4,7-9H2/p+1