[4-(aminomethyl)-1,2-dimethyl-3-oxidanylidene-2,4-dihydropyridin-5-yl]methyl dihydrogen phosphate

Systemtic Name: [4-(aminomethyl)-1,2-dimethyl-3-oxidanylidene-2,4-dihydropyridin-5-yl]methyl dihydrogen phosphate Openeye Name: [4-(aminomethyl)-1,2-dimethyl-3-oxo-2,4-dihydropyridin-5-yl]methyl dihydrogen phosphate CAS Name: [4-(aminomethyl)-1,2-dimethyl-3-oxo-2,4-dihydropyridin-5-yl]methyl dihydrogen phosphate IUPAC Name: [4-(aminomethyl)-1,2-dimethyl-3-oxo-2,4-dihydropyridin-5-yl]methyl dihydrogen phosphate Traditional Name: [4-(aminomethyl)-3-keto-1,2-dimethyl-2,4-dihydropyridin-5-yl]methyl dihydrogen phosphate Formula: C9H17N2O5P MolecularWeight: 264.215441

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C(C(=CN1C)COP(=O)(O)O)CN

Isomeric SMILES

CC1C(=O)C(C(=CN1C)COP(=O)(O)O)CN

InChI

InChI=1S/C9H17N2O5P/c1-6-9(12)8(3-10)7(4-11(6)2)5-16-17(13,14)15/h4,6,8H,3,5,10H2,1-2H3,(H2,13,14,15)