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

Systemtic Name: propan-2-yl (2S,3R)-2-(8-methoxy-8-oxidanylidene-octyl)-3-octyl-aziridine-1-carboxylate Openeye Name: isopropyl (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 propan-2-yl ester IUPAC Name: propan-2-yl (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 isopropyl ester Formula: C23H43NO4 MolecularWeight: 397.59182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H43NO4/c1-5-6-7-8-10-13-16-20-21(24(20)23(26)28-19(2)3)17-14-11-9-12-15-18-22(25)27-4/h19-21H,5-18H2,1-4H3/t20-,21+,24?/m1/s1