2-[[(2-chloranyl-4-nitro-phenyl)carbonyl-ethyl-amino]methyl]-N-ethyl-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[[(2-chloranyl-4-nitro-phenyl)carbonyl-ethyl-amino]methyl]-N-ethyl-1,3-oxazole-4-carboxamide Openeye Name: 2-[[(2-chloro-4-nitro-benzoyl)-ethyl-amino]methyl]-N-ethyl-oxazole-4-carboxamide CAS Name: 2-[[[(2-chloro-4-nitrophenyl)-oxomethyl]-ethylamino]methyl]-N-ethyl-4-oxazolecarboxamide IUPAC Name: 2-[[(2-chloro-4-nitrobenzoyl)-ethylamino]methyl]-N-ethyl-1,3-oxazole-4-carboxamide Traditional Name: 2-[[(2-chloro-4-nitro-benzoyl)-ethyl-amino]methyl]-N-ethyl-oxazole-4-carboxamide Formula: C16H17ClN4O5 MolecularWeight: 380.78298

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=COC(=N1)CN(CC)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCNC(=O)C1=COC(=N1)CN(CC)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O5/c1-3-18-15(22)13-9-26-14(19-13)8-20(4-2)16(23)11-6-5-10(21(24)25)7-12(11)17/h5-7,9H,3-4,8H2,1-2H3,(H,18,22)