ethyl 4-[4-[(4-ethylsulfonylpiperazin-1-yl)methyl]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(4-ethylsulfonylpiperazin-1-yl)methyl]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(4-ethylsulfonyl-1-piperazinyl)methyl]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(4-esylpiperazino)methyl]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H32N4O5S MolecularWeight: 452.56758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)CC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)CC

InChI

InChI=1S/C21H32N4O5S/c1-3-30-21(27)24-13-11-23(12-14-24)20(26)19-7-5-18(6-8-19)17-22-9-15-25(16-10-22)31(28,29)4-2/h5-8H,3-4,9-17H2,1-2H3