[(3-phenylsulfanylphenyl)methoxycarbonylamino] propanoate

Systemtic Name: [(3-phenylsulfanylphenyl)methoxycarbonylamino] propanoate Openeye Name: [(3-phenylsulfanylphenyl)methoxycarbonylamino] propanoate CAS Name: propanoic acid [[oxo-[[3-(phenylthio)phenyl]methoxy]methyl]amino] ester IUPAC Name: [(3-phenylsulfanylphenyl)methoxycarbonylamino] propanoate Traditional Name: propionic acid [[3-(phenylthio)benzyl]oxycarbonylamino] ester Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ONC(=O)OCC1=CC(=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CCC(=O)ONC(=O)OCC1=CC(=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C17H17NO4S/c1-2-16(19)22-18-17(20)21-12-13-7-6-10-15(11-13)23-14-8-4-3-5-9-14/h3-11H,2,12H2,1H3,(H,18,20)