diethyl 2-[6-[(4-chlorophenyl)sulfonylamino]hexyl]-2-(5-pyridin-3-ylpentyl)propanedioate

Systemtic Name: diethyl 2-[6-[(4-chlorophenyl)sulfonylamino]hexyl]-2-(5-pyridin-3-ylpentyl)propanedioate Openeye Name: diethyl 2-[6-[(4-chlorophenyl)sulfonylamino]hexyl]-2-[5-(3-pyridyl)pentyl]propanedioate CAS Name: 2-[6-[(4-chlorophenyl)sulfonylamino]hexyl]-2-[5-(3-pyridinyl)pentyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[6-[(4-chlorophenyl)sulfonylamino]hexyl]-2-(5-pyridin-3-ylpentyl)propanedioate Traditional Name: 2-[6-[(4-chlorophenyl)sulfonylamino]hexyl]-2-[5-(3-pyridyl)pentyl]malonic acid diethyl ester Formula: C29H41ClN2O6S MolecularWeight: 581.16364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)(CCCCCC2=CN=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCCCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)(CCCCCC2=CN=CC=C2)C(=O)OCC

InChI

InChI=1S/C29H41ClN2O6S/c1-3-37-27(33)29(28(34)38-4-2,20-10-7-8-13-24-14-12-21-31-23-24)19-9-5-6-11-22-32-39(35,36)26-17-15-25(30)16-18-26/h12,14-18,21,23,32H,3-11,13,19-20,22H2,1-2H3