2-(4-chlorophenyl)sulfanylethyl 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C18H17ClN2O5S MolecularWeight: 408.85598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC(=O)OCCSC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)OCCSC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O5S/c19-14-3-7-16(8-4-14)27-12-11-26-17(22)9-10-20-18(23)13-1-5-15(6-2-13)21(24)25/h1-8H,9-12H2,(H,20,23)