diethyl 2-[(3-oxidanyl-3-thiophen-2-yl-propyl)amino]nonanedioate

Systemtic Name: diethyl 2-[(3-oxidanyl-3-thiophen-2-yl-propyl)amino]nonanedioate Openeye Name: diethyl 2-[[3-hydroxy-3-(2-thienyl)propyl]amino]nonanedioate CAS Name: 2-[(3-hydroxy-3-thiophen-2-ylpropyl)amino]nonanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3-hydroxy-3-thiophen-2-ylpropyl)amino]nonanedioate Traditional Name: 2-[[3-hydroxy-3-(2-thienyl)propyl]amino]azelaic acid diethyl ester Formula: C20H33NO5S MolecularWeight: 399.54472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC(C(=O)OCC)NCCC(C1=CC=CS1)O

Isomeric SMILES

CCOC(=O)CCCCCCC(C(=O)OCC)NCCC(C1=CC=CS1)O

InChI

InChI=1S/C20H33NO5S/c1-3-25-19(23)12-8-6-5-7-10-16(20(24)26-4-2)21-14-13-17(22)18-11-9-15-27-18/h9,11,15-17,21-22H,3-8,10,12-14H2,1-2H3