4-[[4,6-bis(azanyl)-5-bromanyl-pyridin-3-yl]methyl]-2,6-dimethoxy-phenol

Systemtic Name: 4-[[4,6-bis(azanyl)-5-bromanyl-pyridin-3-yl]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[(4,6-diamino-5-bromo-3-pyridyl)methyl]-2,6-dimethoxy-phenol CAS Name: 4-[(4,6-diamino-5-bromo-3-pyridinyl)methyl]-2,6-dimethoxyphenol IUPAC Name: 4-[(4,6-diamino-5-bromopyridin-3-yl)methyl]-2,6-dimethoxyphenol Traditional Name: 4-[(4,6-diamino-5-bromo-3-pyridyl)methyl]-2,6-dimethoxy-phenol Formula: C14H16BrN3O3 MolecularWeight: 354.19914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CC2=CN=C(C(=C2N)Br)N

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CC2=CN=C(C(=C2N)Br)N

InChI

InChI=1S/C14H16BrN3O3/c1-20-9-4-7(5-10(21-2)13(9)19)3-8-6-18-14(17)11(15)12(8)16/h4-6,19H,3H2,1-2H3,(H4,16,17,18)