N-[[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]pentan-1-amine

Systemtic Name: N-[[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]pentan-1-amine Openeye Name: N-[[3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl]pentan-1-amine CAS Name: N-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-1-pentanamine IUPAC Name: N-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]pentan-1-amine Traditional Name: amyl-[3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]amine Formula: C21H28BrNO2 MolecularWeight: 406.35652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C)OC

Isomeric SMILES

CCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C)OC

InChI

InChI=1S/C21H28BrNO2/c1-4-5-6-11-23-14-18-12-19(22)21(20(13-18)24-3)25-15-17-9-7-16(2)8-10-17/h7-10,12-13,23H,4-6,11,14-15H2,1-3H3