ethyl 4-(2-dodecylsulfanylethanoylamino)benzoate

Systemtic Name: ethyl 4-(2-dodecylsulfanylethanoylamino)benzoate Openeye Name: ethyl 4-[(2-dodecylsulfanylacetyl)amino]benzoate CAS Name: 4-[[2-(dodecylthio)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-dodecylsulfanylacetyl)amino]benzoate Traditional Name: 4-[[2-(laurylthio)acetyl]amino]benzoic acid ethyl ester Formula: C23H37NO3S MolecularWeight: 407.60978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(=O)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCSCC(=O)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C23H37NO3S/c1-3-5-6-7-8-9-10-11-12-13-18-28-19-22(25)24-21-16-14-20(15-17-21)23(26)27-4-2/h14-17H,3-13,18-19H2,1-2H3,(H,24,25)