[(4R,5S)-3-butyl-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-5-yl]methyl cyclohexanecarboxylate

Systemtic Name: [(4R,5S)-3-butyl-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-5-yl]methyl cyclohexanecarboxylate Openeye Name: [(4R,5S)-4-benzyl-3-butyl-2-oxo-oxazolidin-5-yl]methyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [(4R,5S)-3-butyl-2-oxo-4-(phenylmethyl)-5-oxazolidinyl]methyl ester IUPAC Name: [(4R,5S)-4-benzyl-3-butyl-2-oxo-1,3-oxazolidin-5-yl]methyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [(4R,5S)-4-benzyl-3-butyl-2-keto-oxazolidin-5-yl]methyl ester Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(OC1=O)COC(=O)C2CCCCC2)CC3=CC=CC=C3

Isomeric SMILES

CCCCN1[C@@H]([C@H](OC1=O)COC(=O)C2CCCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H31NO4/c1-2-3-14-23-19(15-17-10-6-4-7-11-17)20(27-22(23)25)16-26-21(24)18-12-8-5-9-13-18/h4,6-7,10-11,18-20H,2-3,5,8-9,12-16H2,1H3/t19-,20-/m1/s1