methyl 7-[[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylamino]heptanoate Openeye Name: methyl 7-[[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]amino]heptanoate CAS Name: 7-[[[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]amino]heptanoate Traditional Name: 7-[[1-(4-chlorophenyl)sulfonylisonipecotoyl]amino]enanthic acid methyl ester Formula: C20H29ClN2O5S MolecularWeight: 444.97266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H29ClN2O5S/c1-28-19(24)6-4-2-3-5-13-22-20(25)16-11-14-23(15-12-16)29(26,27)18-9-7-17(21)8-10-18/h7-10,16H,2-6,11-15H2,1H3,(H,22,25)