ethyl (2S)-2-[[[(3aS,4R,6R,6aR)-4-azido-6-[2,4-bis(oxidanylidene)pyrimidin-1-yl]spiro[6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-2,1'-cyclopentane]-4-yl]methoxy-phenoxy-phosphoryl]amino]propanoate

Systemtic Name: ethyl (2S)-2-[[[(3aS,4R,6R,6aR)-4-azido-6-[2,4-bis(oxidanylidene)pyrimidin-1-yl]spiro[6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-2,1'-cyclopentane]-4-yl]methoxy-phenoxy-phosphoryl]amino]propanoate Openeye Name: ethyl (2S)-2-[[[(3aS,4R,6R,6aR)-4-azido-6-(2,4-dioxopyrimidin-1-yl)spiro[6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-2,1'-cyclopentane]-4-yl]methoxy-phenoxy-phosphoryl]amino]propanoate CAS Name: (2S)-2-[[[(3aS,4R,6R,6aR)-4-azido-6-(2,4-dioxo-1-pyrimidinyl)-4-spiro[6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-2,1'-cyclopentane]yl]methoxy-phenoxyphosphoryl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[[(3aS,4R,6R,6aR)-4-azido-6-(2,4-dioxopyrimidin-1-yl)spiro[6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-2,1'-cyclopentane]-4-yl]methoxy-phenoxyphosphoryl]amino]propanoate Traditional Name: (2S)-2-[[[(3aS,4R,6R,6aR)-4-azido-6-(2,4-diketopyrimidin-1-yl)spiro[6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-2,1'-cyclopentane]-4-yl]methoxy-phenoxy-phosphoryl]amino]propionic acid ethyl ester Formula: C25H31N6O10P MolecularWeight: 606.521601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)NP(=O)(OCC1(C2C(C(O1)N3C=CC(=O)NC3=O)OC4(O2)CCCC4)N=[N+]=[N-])OC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)[C@H](C)NP(=O)(OC[C@@]1([C@@H]2[C@H]([C@@H](O1)N3C=CC(=O)NC3=O)OC4(O2)CCCC4)N=[N+]=[N-])OC5=CC=CC=C5

InChI

InChI=1S/C25H31N6O10P/c1-3-36-22(33)16(2)28-42(35,41-17-9-5-4-6-10-17)37-15-25(29-30-26)20-19(38-24(39-20)12-7-8-13-24)21(40-25)31-14-11-18(32)27-23(31)34/h4-6,9-11,14,16,19-21H,3,7-8,12-13,15H2,1-2H3,(H,28,35)(H,27,32,34)/t16-,19+,20-,21+,25+,42?/m0/s1