3-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2,6-dimethyl-phenol

Systemtic Name: 3-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2,6-dimethyl-phenol Openeye Name: 3-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2,6-dimethyl-phenol CAS Name: 3-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2,6-dimethylphenol IUPAC Name: 3-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2,6-dimethylphenol Traditional Name: 3-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2,6-dimethyl-phenol Formula: C16H16BrNO3 MolecularWeight: 350.20714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrNO3/c1-9-3-4-13(10(2)16(9)19)18-7-11-5-14-15(6-12(11)17)21-8-20-14/h3-6,18-19H,7-8H2,1-2H3