2-[(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-[[(4R)-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]carbonyl]pyrrolidin-1-yl]-N,N-dibutyl-ethanamide

Systemtic Name: 2-[(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-[[(4R)-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]carbonyl]pyrrolidin-1-yl]-N,N-dibutyl-ethanamide Openeye Name: 2-[(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-3-[(4R)-4-benzyl-2-oxo-oxazolidine-3-carbonyl]-2-(4-methoxyphenyl)pyrrolidin-1-yl]-N,N-dibutyl-acetamide CAS Name: 2-[(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-[oxo-[(4R)-2-oxo-4-(phenylmethyl)-3-oxazolidinyl]methyl]-1-pyrrolidinyl]-N,N-dibutylacetamide IUPAC Name: 2-[(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-3-[(4R)-4-benzyl-2-oxo-1,3-oxazolidine-3-carbonyl]-2-(4-methoxyphenyl)pyrrolidin-1-yl]-N,N-dibutylacetamide Traditional Name: 2-[(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-3-[(4R)-4-benzyl-2-keto-oxazolidine-3-carbonyl]-2-(4-methoxyphenyl)pyrrolidino]-N,N-dibutyl-acetamide Formula: C39H47N3O7 MolecularWeight: 669.80638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CN1CC(C(C1C2=CC=C(C=C2)OC)C(=O)N3C(COC3=O)CC4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCCCN(CCCC)C(=O)CN1C[C@@H]([C@H]([C@@H]1C2=CC=C(C=C2)OC)C(=O)N3[C@@H](COC3=O)CC4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C39H47N3O7/c1-4-6-19-40(20-7-5-2)35(43)24-41-23-32(29-15-18-33-34(22-29)49-26-48-33)36(37(41)28-13-16-31(46-3)17-14-28)38(44)42-30(25-47-39(42)45)21-27-11-9-8-10-12-27/h8-18,22,30,32,36-37H,4-7,19-21,23-26H2,1-3H3/t30-,32-,36-,37+/m1/s1