ethyl 2-[[(4S,5R,7R)-7-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-oxidanyl-6-oxaspiro[2.4]heptan-5-yl]methoxy-[[(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]phosphoryl]oxybenzoate

Systemtic Name: ethyl 2-[[(4S,5R,7R)-7-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-oxidanyl-6-oxaspiro[2.4]heptan-5-yl]methoxy-[[(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]phosphoryl]oxybenzoate Openeye Name: ethyl 2-[[[(1R)-2-benzyloxy-1-methyl-2-oxo-ethyl]amino]-[[(4S,5R,7R)-7-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-6-oxaspiro[2.4]heptan-5-yl]methoxy]phosphoryl]oxybenzoate CAS Name: 2-[[(4S,5R,7R)-7-(2,4-dioxo-1-pyrimidinyl)-4-hydroxy-6-oxaspiro[2.4]heptan-5-yl]methoxy-[[(2R)-1-oxo-1-phenylmethoxypropan-2-yl]amino]phosphoryl]oxybenzoic acid ethyl ester IUPAC Name: ethyl 2-[[(4S,5R,7R)-7-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-6-oxaspiro[2.4]heptan-5-yl]methoxy-[[(2R)-1-oxo-1-phenylmethoxypropan-2-yl]amino]phosphoryl]oxybenzoate Traditional Name: 2-[[[(1R)-2-benzoxy-2-keto-1-methyl-ethyl]amino]-[[(4S,5R,7R)-7-(2,4-diketopyrimidin-1-yl)-4-hydroxy-6-oxaspiro[2.4]heptan-5-yl]methoxy]phosphoryl]oxybenzoic acid ethyl ester Formula: C30H34N3O11P MolecularWeight: 643.578221

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1OP(=O)(NC(C)C(=O)OCC2=CC=CC=C2)OCC3C(C4(CC4)C(O3)N5C=CC(=O)NC5=O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1OP(=O)(N[C@H](C)C(=O)OCC2=CC=CC=C2)OC[C@@H]3[C@H](C4(CC4)[C@@H](O3)N5C=CC(=O)NC5=O)O

InChI

InChI=1S/C30H34N3O11P/c1-3-40-27(37)21-11-7-8-12-22(21)44-45(39,32-19(2)26(36)41-17-20-9-5-4-6-10-20)42-18-23-25(35)30(14-15-30)28(43-23)33-16-13-24(34)31-29(33)38/h4-13,16,19,23,25,28,35H,3,14-15,17-18H2,1-2H3,(H,32,39)(H,31,34,38)/t19-,23-,25-,28-,45?/m1/s1