[(2S)-1-[4-azanyl-5-(naphthalen-2-ylmethyl)-2-oxidanylidene-pyrimidin-1-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-[4-azanyl-5-(naphthalen-2-ylmethyl)-2-oxidanylidene-pyrimidin-1-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[[4-amino-5-(2-naphthylmethyl)-2-oxo-pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-[4-amino-5-(2-naphthalenylmethyl)-2-oxo-1-pyrimidinyl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-[4-amino-5-(naphthalen-2-ylmethyl)-2-oxopyrimidin-1-yl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[[4-amino-2-keto-5-(2-naphthylmethyl)pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C19H22N3O6P MolecularWeight: 419.368241

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC3=CN(C(=O)N=C3N)CC(CO)OCP(=O)(O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC3=CN(C(=O)N=C3N)C[C@@H](CO)OCP(=O)(O)O

InChI

InChI=1S/C19H22N3O6P/c20-18-16(8-13-5-6-14-3-1-2-4-15(14)7-13)9-22(19(24)21-18)10-17(11-23)28-12-29(25,26)27/h1-7,9,17,23H,8,10-12H2,(H2,20,21,24)(H2,25,26,27)/t17-/m0/s1