propyl 4-[2-(3-phenylsulfanylpropanoyloxy)ethanoylamino]benzoate

Systemtic Name: propyl 4-[2-(3-phenylsulfanylpropanoyloxy)ethanoylamino]benzoate Openeye Name: propyl 4-[[2-(3-phenylsulfanylpropanoyloxy)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[1-oxo-3-(phenylthio)propoxy]ethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(3-phenylsulfanylpropanoyloxy)acetyl]amino]benzoate Traditional Name: 4-[[2-[3-(phenylthio)propanoyloxy]acetyl]amino]benzoic acid propyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C21H23NO5S/c1-2-13-26-21(25)16-8-10-17(11-9-16)22-19(23)15-27-20(24)12-14-28-18-6-4-3-5-7-18/h3-11H,2,12-15H2,1H3,(H,22,23)