pentadecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate

Systemtic Name: pentadecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate Openeye Name: pentadecyl (2S)-2-(isobutoxycarbonylamino)-3-methyl-pentanoate CAS Name: (2S)-3-methyl-2-[[2-methylpropoxy(oxo)methyl]amino]pentanoic acid pentadecyl ester IUPAC Name: pentadecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(isobutoxycarbonylamino)-3-methyl-valeric acid pentadecyl ester Formula: C26H51NO4 MolecularWeight: 441.68744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC(=O)C(C(C)CC)NC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCOC(=O)[C@H](C(C)CC)NC(=O)OCC(C)C

InChI

InChI=1S/C26H51NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-30-25(28)24(23(5)7-2)27-26(29)31-21-22(3)4/h22-24H,6-21H2,1-5H3,(H,27,29)/t23?,24-/m0/s1