4-azanyl-1-[[(2S,3S)-1-diethoxyphosphoryl-3-phenylmethoxy-butan-2-yl]oxymethyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[[(2S,3S)-1-diethoxyphosphoryl-3-phenylmethoxy-butan-2-yl]oxymethyl]pyrimidin-2-one Openeye Name: 4-amino-1-[[(1S,2S)-2-benzyloxy-1-(diethoxyphosphorylmethyl)propoxy]methyl]pyrimidin-2-one CAS Name: 4-amino-1-[[(2S,3S)-1-diethoxyphosphoryl-3-phenylmethoxybutan-2-yl]oxymethyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[[(2S,3S)-1-diethoxyphosphoryl-3-phenylmethoxybutan-2-yl]oxymethyl]pyrimidin-2-one Traditional Name: 4-amino-1-[[(1S,2S)-2-benzoxy-1-(diethoxyphosphorylmethyl)propoxy]methyl]pyrimidin-2-one Formula: C20H30N3O6P MolecularWeight: 439.442461

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(C(C)OCC1=CC=CC=C1)OCN2C=CC(=NC2=O)N)OCC

Isomeric SMILES

CCOP(=O)(C[C@H]([C@H](C)OCC1=CC=CC=C1)OCN2C=CC(=NC2=O)N)OCC

InChI

InChI=1S/C20H30N3O6P/c1-4-28-30(25,29-5-2)14-18(16(3)26-13-17-9-7-6-8-10-17)27-15-23-12-11-19(21)22-20(23)24/h6-12,16,18H,4-5,13-15H2,1-3H3,(H2,21,22,24)/t16-,18+/m0/s1