(3-bromanyl-5-ethoxy-4-octoxy-phenyl)methanamine

Systemtic Name: (3-bromanyl-5-ethoxy-4-octoxy-phenyl)methanamine Openeye Name: (3-bromo-5-ethoxy-4-octoxy-phenyl)methanamine CAS Name: (3-bromo-5-ethoxy-4-octoxyphenyl)methanamine IUPAC Name: (3-bromo-5-ethoxy-4-octoxyphenyl)methanamine Traditional Name: (3-bromo-5-ethoxy-4-octoxy-benzyl)amine Formula: C17H28BrNO2 MolecularWeight: 358.31372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1Br)CN)OCC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1Br)CN)OCC

InChI

InChI=1S/C17H28BrNO2/c1-3-5-6-7-8-9-10-21-17-15(18)11-14(13-19)12-16(17)20-4-2/h11-12H,3-10,13,19H2,1-2H3