tert-butyl (2S)-1-[[(2R,4R,5S,6S)-2-[4-[3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S)-1-[[(2R,4R,5S,6S)-2-[4-[3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S)-1-[[(2R,4R,5S,6S)-2-[4-[3-[(1,3-dioxoisoindolin-2-yl)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[[(2R,4R,5S,6S)-2-[4-[3-[(1,3-dioxo-2-isoindolyl)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-1-[[(2R,4R,5S,6S)-2-[4-[3-[(1,3-dioxoisoindol-2-yl)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[[(2R,4R,5S,6S)-5-methyl-6-(4-methylolphenyl)-2-[4-[3-(phthalimidomethyl)phenyl]phenyl]-1,3-dioxan-4-yl]methyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C43H46N2O7 MolecularWeight: 702.83454

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CN5C(=O)C6=CC=CC=C6C5=O)CN7CCCC7C(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H]1[C@@H](O[C@@H](O[C@@H]1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CN5C(=O)C6=CC=CC=C6C5=O)CN7CCC[C@H]7C(=O)OC(C)(C)C

InChI

InChI=1S/C43H46N2O7/c1-27-37(25-44-22-8-13-36(44)41(49)52-43(2,3)4)50-42(51-38(27)31-16-14-28(26-46)15-17-31)32-20-18-30(19-21-32)33-10-7-9-29(23-33)24-45-39(47)34-11-5-6-12-35(34)40(45)48/h5-7,9-12,14-21,23,27,36-38,42,46H,8,13,22,24-26H2,1-4H3/t27-,36+,37+,38+,42+/m1/s1