methyl 2-[4-[2-(4-chloranylphenoxy)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[2-(4-chloranylphenoxy)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[2-(4-chlorophenoxy)ethylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[2-(4-chlorophenoxy)ethylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[2-(4-chlorophenoxy)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[2-(4-chlorophenoxy)ethylcarbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O6S/c1-30-22(27)19-4-2-3-5-20(19)32(28,29)25-13-10-16(11-14-25)21(26)24-12-15-31-18-8-6-17(23)7-9-18/h2-9,16H,10-15H2,1H3,(H,24,26)