methyl 1-(4-dimethylaminophenyl)carbonyl-4-ethylsulfonyl-piperazine-2-carboxylate

Systemtic Name: methyl 1-(4-dimethylaminophenyl)carbonyl-4-ethylsulfonyl-piperazine-2-carboxylate Openeye Name: methyl 1-[4-(dimethylamino)benzoyl]-4-ethylsulfonyl-piperazine-2-carboxylate CAS Name: 1-[(4-dimethylaminophenyl)-oxomethyl]-4-ethylsulfonyl-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(dimethylamino)benzoyl]-4-ethylsulfonylpiperazine-2-carboxylate Traditional Name: 1-[4-(dimethylamino)benzoyl]-4-esyl-piperazine-2-carboxylic acid methyl ester Formula: C17H25N3O5S MolecularWeight: 383.4625

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(C(C1)C(=O)OC)C(=O)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCS(=O)(=O)N1CCN(C(C1)C(=O)OC)C(=O)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C17H25N3O5S/c1-5-26(23,24)19-10-11-20(15(12-19)17(22)25-4)16(21)13-6-8-14(9-7-13)18(2)3/h6-9,15H,5,10-12H2,1-4H3