[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-prop-2-enyl-azanium

Systemtic Name: [3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-prop-2-enyl-azanium Openeye Name: allyl-[(4-benzyloxy-3,5-dibromo-phenyl)methyl]ammonium CAS Name: (3,5-dibromo-4-phenylmethoxyphenyl)methyl-prop-2-enylammonium IUPAC Name: (3,5-dibromo-4-phenylmethoxyphenyl)methyl-prop-2-enylazanium Traditional Name: allyl-(4-benzoxy-3,5-dibromo-benzyl)ammonium Formula: C17H18Br2NO+ MolecularWeight: 412.13892

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)Br

Isomeric SMILES

C=CC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C17H17Br2NO/c1-2-8-20-11-14-9-15(18)17(16(19)10-14)21-12-13-6-4-3-5-7-13/h2-7,9-10,20H,1,8,11-12H2/p+1