ethyl 2-[2-methoxy-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-methoxy-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-phenoxy]ethanoate Openeye Name: ethyl 2-[2-methoxy-5-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-phenoxy]acetate CAS Name: 2-[2-methoxy-5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-methoxy-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]acetate Traditional Name: 2-[2-methoxy-5-[4-(2-pyridyl)piperazino]sulfonyl-phenoxy]acetic acid ethyl ester Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O6S/c1-3-28-20(24)15-29-18-14-16(7-8-17(18)27-2)30(25,26)23-12-10-22(11-13-23)19-6-4-5-9-21-19/h4-9,14H,3,10-13,15H2,1-2H3