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

Systemtic Name: undecyl (2S)-2-(butoxycarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: undecyl (2S)-2-(butoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[butoxy(oxo)methyl]amino]-4-(methylthio)butanoic acid undecyl ester IUPAC Name: undecyl (2S)-2-(butoxycarbonylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(butoxycarbonylamino)-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)OCCCC

Isomeric SMILES

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

InChI

InChI=1S/C21H41NO4S/c1-4-6-8-9-10-11-12-13-14-17-25-20(23)19(15-18-27-3)22-21(24)26-16-7-5-2/h19H,4-18H2,1-3H3,(H,22,24)/t19-/m0/s1