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

Systemtic Name: N-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]hexan-1-amine Openeye Name: N-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methyl]hexan-1-amine CAS Name: N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-hexanamine IUPAC Name: N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]hexan-1-amine Traditional Name: (4-benzoxy-3-bromo-5-methoxy-benzyl)-hexyl-amine Formula: C21H28BrNO2 MolecularWeight: 406.35652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)OC

Isomeric SMILES

CCCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)OC

InChI

InChI=1S/C21H28BrNO2/c1-3-4-5-9-12-23-15-18-13-19(22)21(20(14-18)24-2)25-16-17-10-7-6-8-11-17/h6-8,10-11,13-14,23H,3-5,9,12,15-16H2,1-2H3