ethyl 3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: ethyl 3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: ethyl 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 3-[[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H31N3O5S/c1-4-29-21(26)23-9-5-6-18(15-23)20(25)22-10-12-24(13-11-22)30(27,28)19-8-7-16(2)14-17(19)3/h7-8,14,18H,4-6,9-13,15H2,1-3H3