undecyl (2S)-2-(2-methylpropoxycarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: undecyl (2S)-2-(2-methylpropoxycarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: undecyl (2S)-2-(isobutoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-methylpropoxy(oxo)methyl]amino]-4-(methylthio)butanoic acid undecyl ester IUPAC Name: undecyl (2S)-2-(2-methylpropoxycarbonylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(isobutoxycarbonylamino)-4-(methylthio)butyric acid undecyl ester Formula: C21H41NO4S MolecularWeight: 403.61954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C(CCSC)NC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCCCCCOC(=O)[C@H](CCSC)NC(=O)OCC(C)C

InChI

InChI=1S/C21H41NO4S/c1-5-6-7-8-9-10-11-12-13-15-25-20(23)19(14-16-27-4)22-21(24)26-17-18(2)3/h18-19H,5-17H2,1-4H3,(H,22,24)/t19-/m0/s1