[(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 5-nitrofuran-2-carboxylate

Systemtic Name: [(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 5-nitrofuran-2-carboxylate Openeye Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl] 5-nitrofuran-2-carboxylate CAS Name: 5-nitro-2-furancarboxylic acid [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 5-nitrofuran-2-carboxylate Traditional Name: 5-nitrofuran-2-carboxylic acid [(1S)-2-keto-2-(o-phenetidino)-1-phenyl-ethyl] ester Formula: C21H18N2O7 MolecularWeight: 410.37682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O7/c1-2-28-16-11-7-6-10-15(16)22-20(24)19(14-8-4-3-5-9-14)30-21(25)17-12-13-18(29-17)23(26)27/h3-13,19H,2H2,1H3,(H,22,24)/t19-/m0/s1