3-[[(2R,3S,3aS,7aR)-7a-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3-methoxy-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4,5,7-tetrahydro-2H-furo[2,3-c]pyran-3a-yl]oxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile

Systemtic Name: 3-[[(2R,3S,3aS,7aR)-7a-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3-methoxy-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4,5,7-tetrahydro-2H-furo[2,3-c]pyran-3a-yl]oxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile Openeye Name: 3-[[(2R,3S,3aS,7aR)-7a-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3-methoxy-2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-3,4,5,7-tetrahydro-2H-furo[2,3-c]pyran-3a-yl]oxy-(diisopropylamino)phosphanyl]oxypropanenitrile CAS Name: 3-[[(2R,3S,3aS,7aR)-7a-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-methoxy-2-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3,4,5,7-tetrahydro-2H-furo[2,3-c]pyran-3a-yl]oxy-[di(propan-2-yl)amino]phosphino]oxypropanenitrile IUPAC Name: 3-[[(2R,3S,3aS,7aR)-7a-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-methoxy-2-(5-methyl-2,4-dioxopyrimidin-1-yl)-3,4,5,7-tetrahydro-2H-furo[2,3-c]pyran-3a-yl]oxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile Traditional Name: 3-[[(2R,3S,3aS,7aR)-7a-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-2-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-methoxy-3,4,5,7-tetrahydro-2H-furo[2,3-c]pyran-3a-yl]oxy-(diisopropylamino)phosphino]oxypropionitrile Formula: C44H55N4O10P MolecularWeight: 830.902061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2C(C3(CCOCC3(O2)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OP(N(C(C)C)C(C)C)OCCC#N)OC

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@]3(CCOC[C@@]3(O2)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OP(N(C(C)C)C(C)C)OCCC#N)OC

InChI

InChI=1S/C44H55N4O10P/c1-30(2)48(31(3)4)59(56-25-12-24-45)58-43-23-26-54-28-42(43,57-40(38(43)53-8)47-27-32(5)39(49)46-41(47)50)29-55-44(33-13-10-9-11-14-33,34-15-19-36(51-6)20-16-34)35-17-21-37(52-7)22-18-35/h9-11,13-22,27,30-31,38,40H,12,23,25-26,28-29H2,1-8H3,(H,46,49,50)/t38-,40-,42-,43+,59?/m1/s1