N-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methyl]hexan-1-amine

Systemtic Name: N-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methyl]hexan-1-amine Openeye Name: N-[(3-bromo-5-methoxy-4-propoxy-phenyl)methyl]hexan-1-amine CAS Name: N-[(3-bromo-5-methoxy-4-propoxyphenyl)methyl]-1-hexanamine IUPAC Name: N-[(3-bromo-5-methoxy-4-propoxyphenyl)methyl]hexan-1-amine Traditional Name: (3-bromo-5-methoxy-4-propoxy-benzyl)-hexyl-amine Formula: C17H28BrNO2 MolecularWeight: 358.31372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1=CC(=C(C(=C1)Br)OCCC)OC

Isomeric SMILES

CCCCCCNCC1=CC(=C(C(=C1)Br)OCCC)OC

InChI

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