ethyl (2S,3R)-2-(8-methoxy-8-oxidanylidene-octyl)-3-octyl-aziridine-1-carboxylate

Systemtic Name: ethyl (2S,3R)-2-(8-methoxy-8-oxidanylidene-octyl)-3-octyl-aziridine-1-carboxylate Openeye Name: ethyl (2S,3R)-2-(8-methoxy-8-oxo-octyl)-3-octyl-aziridine-1-carboxylate CAS Name: (2S,3R)-2-(8-methoxy-8-oxooctyl)-3-octyl-1-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-(8-methoxy-8-oxooctyl)-3-octylaziridine-1-carboxylate Traditional Name: (2S,3R)-2-(8-keto-8-methoxy-octyl)-3-octyl-ethylenimine-1-carboxylic acid ethyl ester Formula: C22H41NO4 MolecularWeight: 383.56524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(N1C(=O)OCC)CCCCCCCC(=O)OC

Isomeric SMILES

CCCCCCCC[C@@H]1[C@@H](N1C(=O)OCC)CCCCCCCC(=O)OC

InChI

InChI=1S/C22H41NO4/c1-4-6-7-8-10-13-16-19-20(23(19)22(25)27-5-2)17-14-11-9-12-15-18-21(24)26-3/h19-20H,4-18H2,1-3H3/t19-,20+,23?/m1/s1