1-[(2R,4S,5S)-5-[(E,1S)-1-[bis(4-methoxyphenyl)-phenyl-methoxy]-6-bromanyl-hex-3-enyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,4S,5S)-5-[(E,1S)-1-[bis(4-methoxyphenyl)-phenyl-methoxy]-6-bromanyl-hex-3-enyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,4S,5S)-5-[(E,1S)-1-[bis(4-methoxyphenyl)-phenyl-methoxy]-6-bromo-hex-3-enyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,4S,5S)-5-[(E,1S)-1-[bis(4-methoxyphenyl)-phenylmethoxy]-6-bromohex-3-enyl]-4-hydroxy-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,4S,5S)-5-[(E,1S)-1-[bis(4-methoxyphenyl)-phenylmethoxy]-6-bromohex-3-enyl]-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,4S,5S)-5-[(E,1S)-1-[bis(4-methoxyphenyl)-phenyl-methoxy]-6-bromo-hex-3-enyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C36H39BrN2O7 MolecularWeight: 691.60806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)C(CC=CCCBr)OC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)[C@H](C/C=C/CCBr)OC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)O

InChI

InChI=1S/C36H39BrN2O7/c1-24-23-39(35(42)38-34(24)41)32-22-30(40)33(45-32)31(12-8-5-9-21-37)46-36(25-10-6-4-7-11-25,26-13-17-28(43-2)18-14-26)27-15-19-29(44-3)20-16-27/h4-8,10-11,13-20,23,30-33,40H,9,12,21-22H2,1-3H3,(H,38,41,42)/b8-5+/t30-,31-,32+,33-/m0/s1