methyl 2-[[3-chloranyl-4-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[3-chloranyl-4-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[3-chloro-4-[(1-methylsulfonyl-4-piperidyl)oxy]benzoyl]amino]acetate CAS Name: 2-[[[3-chloro-4-[(1-methylsulfonyl-4-piperidinyl)oxy]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxybenzoyl]amino]acetate Traditional Name: 2-[[3-chloro-4-[(1-mesyl-4-piperidyl)oxy]benzoyl]amino]acetic acid methyl ester Formula: C16H21ClN2O6S MolecularWeight: 404.86574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)S(=O)(=O)C)Cl

Isomeric SMILES

COC(=O)CNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)S(=O)(=O)C)Cl

InChI

InChI=1S/C16H21ClN2O6S/c1-24-15(20)10-18-16(21)11-3-4-14(13(17)9-11)25-12-5-7-19(8-6-12)26(2,22)23/h3-4,9,12H,5-8,10H2,1-2H3,(H,18,21)