1-(3,4-dimethylphenyl)-2-[2,4,6-tris(bromanyl)phenoxy]ethanamine

Systemtic Name: 1-(3,4-dimethylphenyl)-2-[2,4,6-tris(bromanyl)phenoxy]ethanamine Openeye Name: 1-(3,4-dimethylphenyl)-2-(2,4,6-tribromophenoxy)ethanamine CAS Name: 1-(3,4-dimethylphenyl)-2-(2,4,6-tribromophenoxy)ethanamine IUPAC Name: 1-(3,4-dimethylphenyl)-2-(2,4,6-tribromophenoxy)ethanamine Traditional Name: [1-(3,4-dimethylphenyl)-2-(2,4,6-tribromophenoxy)ethyl]amine Formula: C16H16Br3NO MolecularWeight: 478.01634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(COC2=C(C=C(C=C2Br)Br)Br)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(COC2=C(C=C(C=C2Br)Br)Br)N)C

InChI

InChI=1S/C16H16Br3NO/c1-9-3-4-11(5-10(9)2)15(20)8-21-16-13(18)6-12(17)7-14(16)19/h3-7,15H,8,20H2,1-2H3