N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-3-iodanyl-4-methyl-aniline

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-3-iodanyl-4-methyl-aniline Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-iodo-4-methyl-aniline CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-iodo-4-methylaniline IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-iodo-4-methylaniline Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-(3-iodo-4-methyl-phenyl)amine Formula: C15H13BrINO2 MolecularWeight: 446.07769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC3=C(C=C2Br)OCO3)I

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC3=C(C=C2Br)OCO3)I

InChI

InChI=1S/C15H13BrINO2/c1-9-2-3-11(5-13(9)17)18-7-10-4-14-15(6-12(10)16)20-8-19-14/h2-6,18H,7-8H2,1H3