1-[4-bromanyl-2-(2-butan-2-ylphenoxy)phenyl]-N-methyl-methanamine

Systemtic Name: 1-[4-bromanyl-2-(2-butan-2-ylphenoxy)phenyl]-N-methyl-methanamine Openeye Name: 1-[4-bromo-2-(2-sec-butylphenoxy)phenyl]-N-methyl-methanamine CAS Name: 1-[4-bromo-2-(2-butan-2-ylphenoxy)phenyl]-N-methylmethanamine IUPAC Name: 1-[4-bromo-2-(2-butan-2-ylphenoxy)phenyl]-N-methylmethanamine Traditional Name: [4-bromo-2-(2-sec-butylphenoxy)benzyl]-methyl-amine Formula: C18H22BrNO MolecularWeight: 348.27738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OC2=C(C=CC(=C2)Br)CNC

Isomeric SMILES

CCC(C)C1=CC=CC=C1OC2=C(C=CC(=C2)Br)CNC

InChI

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