N-[[4-bromanyl-2-(2,3,5-trimethylphenoxy)phenyl]methyl]ethanamine

Systemtic Name: N-[[4-bromanyl-2-(2,3,5-trimethylphenoxy)phenyl]methyl]ethanamine Openeye Name: N-[[4-bromo-2-(2,3,5-trimethylphenoxy)phenyl]methyl]ethanamine CAS Name: N-[[4-bromo-2-(2,3,5-trimethylphenoxy)phenyl]methyl]ethanamine IUPAC Name: N-[[4-bromo-2-(2,3,5-trimethylphenoxy)phenyl]methyl]ethanamine Traditional Name: [4-bromo-2-(2,3,5-trimethylphenoxy)benzyl]-ethyl-amine Formula: C18H22BrNO MolecularWeight: 348.27738

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(C=C(C=C1)Br)OC2=CC(=CC(=C2C)C)C

Isomeric SMILES

CCNCC1=C(C=C(C=C1)Br)OC2=CC(=CC(=C2C)C)C

InChI

InChI=1S/C18H22BrNO/c1-5-20-11-15-6-7-16(19)10-18(15)21-17-9-12(2)8-13(3)14(17)4/h6-10,20H,5,11H2,1-4H3