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

Systemtic Name: ethyl 2-[4-(4-butylphenyl)sulfonylpiperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-(4-butylphenyl)sulfonylpiperazin-1-yl]acetate CAS Name: 2-[4-(4-butylphenyl)sulfonyl-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-butylphenyl)sulfonylpiperazin-1-yl]acetate Traditional Name: 2-[4-(4-butylphenyl)sulfonylpiperazino]acetic acid ethyl ester Formula: C18H28N2O4S MolecularWeight: 368.49092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)OCC

InChI

InChI=1S/C18H28N2O4S/c1-3-5-6-16-7-9-17(10-8-16)25(22,23)20-13-11-19(12-14-20)15-18(21)24-4-2/h7-10H,3-6,11-15H2,1-2H3