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

Systemtic Name: heptadecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate Openeye Name: heptadecyl (2S)-2-(isobutoxycarbonylamino)-3-methyl-pentanoate CAS Name: (2S)-3-methyl-2-[[2-methylpropoxy(oxo)methyl]amino]pentanoic acid heptadecyl ester IUPAC Name: heptadecyl (2S)-3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(isobutoxycarbonylamino)-3-methyl-valeric acid heptadecyl ester Formula: C28H55NO4 MolecularWeight: 469.7406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H55NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-32-27(30)26(25(5)7-2)29-28(31)33-23-24(3)4/h24-26H,6-23H2,1-5H3,(H,29,31)/t25?,26-/m0/s1