ethyl 2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]acetate CAS Name: 2-[4-(4-butoxyphenyl)sulfonyl-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]acetate Traditional Name: 2-[4-(4-butoxyphenyl)sulfonylpiperazino]acetic acid ethyl ester Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)OCC

InChI

InChI=1S/C18H28N2O5S/c1-3-5-14-25-16-6-8-17(9-7-16)26(22,23)20-12-10-19(11-13-20)15-18(21)24-4-2/h6-9H,3-5,10-15H2,1-2H3