methyl 2-[[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[2-(1,3-benzodioxol-5-yloxymethyl)morpholine-4-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[2-(1,3-benzodioxol-5-yloxymethyl)-4-morpholinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[2-(1,3-benzodioxol-5-yloxymethyl)morpholine-4-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(1,3-benzodioxol-5-yloxymethyl)morpholine-4-carbonyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C19H26N2O7S MolecularWeight: 426.48394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)N1CCOC(C1)COC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)N1CCOC(C1)COC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H26N2O7S/c1-24-18(22)15(5-8-29-2)20-19(23)21-6-7-25-14(10-21)11-26-13-3-4-16-17(9-13)28-12-27-16/h3-4,9,14-15H,5-8,10-12H2,1-2H3,(H,20,23)