ethyl 4-[2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(4-ethoxy-3-methylphenyl)sulfonyl-ethylamino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-ethoxy-3-methylphenyl)sulfonyl-ethylamino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H31N3O6S MolecularWeight: 441.54164

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CCN(CC1)C(=O)OCC)S(=O)(=O)C2=CC(=C(C=C2)OCC)C

Isomeric SMILES

CCN(CC(=O)N1CCN(CC1)C(=O)OCC)S(=O)(=O)C2=CC(=C(C=C2)OCC)C

InChI

InChI=1S/C20H31N3O6S/c1-5-23(30(26,27)17-8-9-18(28-6-2)16(4)14-17)15-19(24)21-10-12-22(13-11-21)20(25)29-7-3/h8-9,14H,5-7,10-13,15H2,1-4H3