ethyl 3-(2-iodanyl-4-nitro-phenyl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: ethyl 3-(2-iodanyl-4-nitro-phenyl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: ethyl 2-(benzyloxycarbonylamino)-3-(2-iodo-4-nitro-phenyl)propanoate CAS Name: 3-(2-iodo-4-nitrophenyl)-2-(phenylmethoxycarbonylamino)propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-iodo-4-nitrophenyl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(2-iodo-4-nitro-phenyl)propionic acid ethyl ester Formula: C19H19IN2O6 MolecularWeight: 498.26843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C=C(C=C1)[N+](=O)[O-])I)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CC1=C(C=C(C=C1)[N+](=O)[O-])I)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H19IN2O6/c1-2-27-18(23)17(10-14-8-9-15(22(25)26)11-16(14)20)21-19(24)28-12-13-6-4-3-5-7-13/h3-9,11,17H,2,10,12H2,1H3,(H,21,24)