2-phenoxyethanoic acid; 12-propylsulfanyldodecanamide

Systemtic Name: 2-phenoxyethanoic acid; 12-propylsulfanyldodecanamide Openeye Name: 2-phenoxyacetic acid; 12-propylsulfanyldodecanamide CAS Name: 2-phenoxyacetic acid; 12-(propylthio)dodecanamide IUPAC Name: 2-phenoxyacetic acid; 12-propylsulfanyldodecanamide Traditional Name: 2-phenoxyacetic acid; 12-(propylthio)lauramide Formula: C23H39NO4S MolecularWeight: 425.62506

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCCCCCCCCCC(=O)N.C1=CC=C(C=C1)OCC(=O)O

Isomeric SMILES

CCCSCCCCCCCCCCCC(=O)N.C1=CC=C(C=C1)OCC(=O)O

InChI

InChI=1S/C15H31NOS.C8H8O3/c1-2-13-18-14-11-9-7-5-3-4-6-8-10-12-15(16)17;9-8(10)6-11-7-4-2-1-3-5-7/h2-14H2,1H3,(H2,16,17);1-5H,6H2,(H,9,10)