tridecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)butanoate

Systemtic Name: tridecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)butanoate Openeye Name: tridecyl (2S)-2-(isobutoxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-[[2-methylpropoxy(oxo)methyl]amino]butanoic acid tridecyl ester IUPAC Name: tridecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)butanoate Traditional Name: (2S)-2-(isobutoxycarbonylamino)-3-methyl-butyric acid tridecyl ester Formula: C23H45NO4 MolecularWeight: 399.6077

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)C(C(C)C)NC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)[C@H](C(C)C)NC(=O)OCC(C)C

InChI

InChI=1S/C23H45NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-27-22(25)21(20(4)5)24-23(26)28-18-19(2)3/h19-21H,6-18H2,1-5H3,(H,24,26)/t21-/m0/s1