ethyl 2-[(5-chloranyl-2-nitro-phenyl)sulfonyl-ethyl-amino]propanoate

Systemtic Name: ethyl 2-[(5-chloranyl-2-nitro-phenyl)sulfonyl-ethyl-amino]propanoate Openeye Name: ethyl 2-[(5-chloro-2-nitro-phenyl)sulfonyl-ethyl-amino]propanoate CAS Name: 2-[(5-chloro-2-nitrophenyl)sulfonyl-ethylamino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-chloro-2-nitrophenyl)sulfonyl-ethylamino]propanoate Traditional Name: 2-[(5-chloro-2-nitro-phenyl)sulfonyl-ethyl-amino]propionic acid ethyl ester Formula: C13H17ClN2O6S MolecularWeight: 364.80188

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)C(=O)OCC)S(=O)(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(C(C)C(=O)OCC)S(=O)(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H17ClN2O6S/c1-4-15(9(3)13(17)22-5-2)23(20,21)12-8-10(14)6-7-11(12)16(18)19/h6-9H,4-5H2,1-3H3