dilithium 1-[(2S)-3-oxidanyl-2-(phosphonatomethoxy)propyl]-5-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: dilithium 1-[(2S)-3-oxidanyl-2-(phosphonatomethoxy)propyl]-5-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: dilithium 5-benzyl-1-[(2S)-3-hydroxy-2-(phosphonatomethoxy)propyl]pyrimidine-2,4-dione CAS Name: dilithium 1-[(2S)-3-hydroxy-2-(phosphonatomethoxy)propyl]-5-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: dilithium 5-benzyl-1-[(2S)-3-hydroxy-2-(phosphonatomethoxy)propyl]pyrimidine-2,4-dione Traditional Name: dilithium 5-benzyl-1-[(2S)-3-hydroxy-2-(phosphonatomethoxy)propyl]pyrimidine-2,4-quinone Formula: C15H17Li2N2O7P MolecularWeight: 382.160441

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].C1=CC=C(C=C1)CC2=CN(C(=O)NC2=O)CC(CO)OCP(=O)([O-])[O-]

Isomeric SMILES

[Li+].[Li+].C1=CC=C(C=C1)CC2=CN(C(=O)NC2=O)C[C@@H](CO)OCP(=O)([O-])[O-]

InChI

InChI=1S/C15H19N2O7P.2Li/c18-9-13(24-10-25(21,22)23)8-17-7-12(14(19)16-15(17)20)6-11-4-2-1-3-5-11;;/h1-5,7,13,18H,6,8-10H2,(H,16,19,20)(H2,21,22,23);;/q;2*+1/p-2/t13-;;/m0../s1