[4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino] [5-(pyridin-3-ylmethyl)pyridin-3-yl]oxy hydrogen phosphate

Systemtic Name: [4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino] [5-(pyridin-3-ylmethyl)pyridin-3-yl]oxy hydrogen phosphate Openeye Name: [4-(5-bromo-3-methyl-2-pyridyl)butylamino] [5-(3-pyridylmethyl)-3-pyridyl]oxy hydrogen phosphate CAS Name: [4-(5-bromo-3-methyl-2-pyridinyl)butylamino] [5-(3-pyridinylmethyl)-3-pyridinyl]oxy hydrogen phosphate IUPAC Name: [4-(5-bromo-3-methylpyridin-2-yl)butylamino] [5-(pyridin-3-ylmethyl)pyridin-3-yl]oxy hydrogen phosphate Traditional Name: [4-(5-bromo-3-methyl-2-pyridyl)butylamino] [5-(3-pyridylmethyl)-3-pyridyl]oxy hydrogen phosphate Formula: C21H24BrN4O5P MolecularWeight: 523.316821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1CCCCNOP(=O)(O)OOC2=CN=CC(=C2)CC3=CN=CC=C3)Br

Isomeric SMILES

CC1=CC(=CN=C1CCCCNOP(=O)(O)OOC2=CN=CC(=C2)CC3=CN=CC=C3)Br

InChI

InChI=1S/C21H24BrN4O5P/c1-16-9-19(22)14-25-21(16)6-2-3-8-26-30-32(27,28)31-29-20-11-18(13-24-15-20)10-17-5-4-7-23-12-17/h4-5,7,9,11-15,26H,2-3,6,8,10H2,1H3,(H,27,28)