ethyl 4-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: ethyl 4-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 4-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylic acid ethyl ester Formula: C22H33N3O5S MolecularWeight: 451.57952

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C22H33N3O5S/c1-3-5-18-6-8-20(9-7-18)31(28,29)25-16-14-23(15-17-25)21(26)19-10-12-24(13-11-19)22(27)30-4-2/h6-9,19H,3-5,10-17H2,1-2H3