methyl 2-(5-butylnonan-5-yloxycarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-(5-butylnonan-5-yloxycarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: methyl 2-(1,1-dibutylpentoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[5-butylnonan-5-yloxy(oxo)methyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(5-butylnonan-5-yloxycarbonylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(1,1-dibutylpentoxycarbonylamino)-4-(methylthio)butyric acid methyl ester Formula: C20H39NO4S MolecularWeight: 389.59296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(CCCC)OC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CCCCC(CCCC)(CCCC)OC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C20H39NO4S/c1-6-9-13-20(14-10-7-2,15-11-8-3)25-19(23)21-17(12-16-26-5)18(22)24-4/h17H,6-16H2,1-5H3,(H,21,23)