4-azanyl-1-[(1R,2S)-2-[di(propan-2-yloxy)phosphorylmethoxymethyl]-1-phenyl-cyclopropyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(1R,2S)-2-[di(propan-2-yloxy)phosphorylmethoxymethyl]-1-phenyl-cyclopropyl]pyrimidin-2-one Openeye Name: 4-amino-1-[(1R,2S)-2-(diisopropoxyphosphorylmethoxymethyl)-1-phenyl-cyclopropyl]pyrimidin-2-one CAS Name: 4-amino-1-[(1R,2S)-2-[di(propan-2-yloxy)phosphorylmethoxymethyl]-1-phenylcyclopropyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(1R,2S)-2-[di(propan-2-yloxy)phosphorylmethoxymethyl]-1-phenylcyclopropyl]pyrimidin-2-one Traditional Name: 4-amino-1-[(1R,2S)-2-(diisopropoxyphosphorylmethoxymethyl)-1-phenyl-cyclopropyl]pyrimidin-2-one Formula: C21H30N3O5P MolecularWeight: 435.453761

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COCC1CC1(C2=CC=CC=C2)N3C=CC(=NC3=O)N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COC[C@H]1C[C@@]1(C2=CC=CC=C2)N3C=CC(=NC3=O)N)OC(C)C

InChI

InChI=1S/C21H30N3O5P/c1-15(2)28-30(26,29-16(3)4)14-27-13-18-12-21(18,17-8-6-5-7-9-17)24-11-10-19(22)23-20(24)25/h5-11,15-16,18H,12-14H2,1-4H3,(H2,22,23,25)/t18-,21+/m1/s1