methyl 2-[[4-(5-chloranylpyridin-2-yl)oxypiperidin-1-yl]oxysulfinylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[4-(5-chloranylpyridin-2-yl)oxypiperidin-1-yl]oxysulfinylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[4-[(5-chloro-2-pyridyl)oxy]-1-piperidyl]oxysulfinylamino]-3-methyl-butanoate CAS Name: 2-[[4-[(5-chloro-2-pyridinyl)oxy]-1-piperidinyl]oxysulfinylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[4-(5-chloropyridin-2-yl)oxypiperidin-1-yl]oxysulfinylamino]-3-methylbutanoate Traditional Name: 2-[[4-[(5-chloro-2-pyridyl)oxy]piperidino]oxysulfinylamino]-3-methyl-butyric acid methyl ester Formula: C16H24ClN3O5S MolecularWeight: 405.89686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)ON1CCC(CC1)OC2=NC=C(C=C2)Cl

Isomeric SMILES

CC(C)C(C(=O)OC)NS(=O)ON1CCC(CC1)OC2=NC=C(C=C2)Cl

InChI

InChI=1S/C16H24ClN3O5S/c1-11(2)15(16(21)23-3)19-26(22)25-20-8-6-13(7-9-20)24-14-5-4-12(17)10-18-14/h4-5,10-11,13,15,19H,6-9H2,1-3H3