ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[(2,5-dimethylphenyl)sulfonylamino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[(2,5-dimethylphenyl)sulfonylamino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNS(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNS(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H31N3O5S/c1-4-28-20(25)23-12-9-17(10-13-23)22-19(24)6-5-11-21-29(26,27)18-14-15(2)7-8-16(18)3/h7-8,14,17,21H,4-6,9-13H2,1-3H3,(H,22,24)