N-[[4-bromanyl-2-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine

Systemtic Name: N-[[4-bromanyl-2-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine Openeye Name: N-[[4-bromo-2-(4-isopropylphenoxy)phenyl]methyl]ethanamine CAS Name: N-[[4-bromo-2-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine IUPAC Name: N-[[4-bromo-2-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine Traditional Name: [4-bromo-2-(4-isopropylphenoxy)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=C(C=C2)C(C)C

Isomeric SMILES

CCNCC1=C(C=C(C=C1)Br)OC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C18H22BrNO/c1-4-20-12-15-5-8-16(19)11-18(15)21-17-9-6-14(7-10-17)13(2)3/h5-11,13,20H,4,12H2,1-3H3