tert-butyl N-[(2S)-1-oxidanyl-3-oxidanylidene-heptadecan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-oxidanyl-3-oxidanylidene-heptadecan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(hydroxymethyl)-2-oxo-hexadecyl]carbamate CAS Name: N-[(2S)-1-hydroxy-3-oxoheptadecan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-hydroxy-3-oxoheptadecan-2-yl]carbamate Traditional Name: N-[(1S)-2-keto-1-methylol-hexadecyl]carbamic acid tert-butyl ester Formula: C22H43NO4 MolecularWeight: 385.58112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)C(CO)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)[C@H](CO)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H43NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20(25)19(18-24)23-21(26)27-22(2,3)4/h19,24H,5-18H2,1-4H3,(H,23,26)/t19-/m0/s1