[2-(methylamino)-1-(4-nitrophenyl)-3-oxidanylidene-3-phenyl-propyl] ethanoate; perchloric acid

Systemtic Name: [2-(methylamino)-1-(4-nitrophenyl)-3-oxidanylidene-3-phenyl-propyl] ethanoate; perchloric acid Openeye Name: [2-(methylamino)-1-(4-nitrophenyl)-3-oxo-3-phenyl-propyl] acetate; perchloric acid CAS Name: acetic acid [2-(methylamino)-1-(4-nitrophenyl)-3-oxo-3-phenylpropyl] ester; perchloric acid IUPAC Name: [2-(methylamino)-1-(4-nitrophenyl)-3-oxo-3-phenylpropyl] acetate; perchloric acid Traditional Name: acetic acid [3-keto-2-(methylamino)-1-(4-nitrophenyl)-3-phenyl-propyl] ester; perchloric acid Formula: C18H19ClN2O9 MolecularWeight: 442.80446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=C(C=C1)[N+](=O)[O-])C(C(=O)C2=CC=CC=C2)NC.OCl(=O)(=O)=O

Isomeric SMILES

CC(=O)OC(C1=CC=C(C=C1)[N+](=O)[O-])C(C(=O)C2=CC=CC=C2)NC.OCl(=O)(=O)=O

InChI

InChI=1S/C18H18N2O5.ClHO4/c1-12(21)25-18(14-8-10-15(11-9-14)20(23)24)16(19-2)17(22)13-6-4-3-5-7-13;2-1(3,4)5/h3-11,16,18-19H,1-2H3;(H,2,3,4,5)