N-[(6-bromanyl-2-methoxy-3-phenylmethoxy-phenyl)methyl]benzo[f][1,3]benzodioxol-5-amine

Systemtic Name: N-[(6-bromanyl-2-methoxy-3-phenylmethoxy-phenyl)methyl]benzo[f][1,3]benzodioxol-5-amine Openeye Name: N-[(3-benzyloxy-6-bromo-2-methoxy-phenyl)methyl]benzo[f][1,3]benzodioxol-5-amine CAS Name: N-[(6-bromo-2-methoxy-3-phenylmethoxyphenyl)methyl]-5-benzo[f][1,3]benzodioxolamine IUPAC Name: N-[(6-bromo-2-methoxy-3-phenylmethoxyphenyl)methyl]benzo[f][1,3]benzodioxol-5-amine Traditional Name: benzo[f][1,3]benzodioxol-5-yl-(3-benzoxy-6-bromo-2-methoxy-benzyl)amine Formula: C26H22BrNO4 MolecularWeight: 492.36118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1CNC2=CC=CC3=CC4=C(C=C32)OCO4)Br)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1CNC2=CC=CC3=CC4=C(C=C32)OCO4)Br)OCC5=CC=CC=C5

InChI

InChI=1S/C26H22BrNO4/c1-29-26-20(21(27)10-11-23(26)30-15-17-6-3-2-4-7-17)14-28-22-9-5-8-18-12-24-25(13-19(18)22)32-16-31-24/h2-13,28H,14-16H2,1H3