methyl 2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]ethanoate

Systemtic Name: methyl 2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]ethanoate Openeye Name: methyl 2-[4-[4-(2-pyridyl)piperazin-1-yl]sulfonylphenoxy]acetate CAS Name: 2-[4-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]acetate Traditional Name: 2-[4-[4-(2-pyridyl)piperazino]sulfonylphenoxy]acetic acid methyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C18H21N3O5S/c1-25-18(22)14-26-15-5-7-16(8-6-15)27(23,24)21-12-10-20(11-13-21)17-4-2-3-9-19-17/h2-9H,10-14H2,1H3