[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-ethoxyphenoxy)propanoate

Systemtic Name: [(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-ethoxyphenoxy)propanoate Openeye Name: [(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 3-(2-ethoxyphenoxy)propanoate CAS Name: 3-(2-ethoxyphenoxy)propanoic acid [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] 3-(2-ethoxyphenoxy)propanoate Traditional Name: 3-(2-ethoxyphenoxy)propionic acid [(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCC(=O)OC(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1OCCC(=O)O[C@H](C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O7/c1-3-27-17-10-6-7-11-18(17)28-13-12-19(23)29-14(2)20(24)21-15-8-4-5-9-16(15)22(25)26/h4-11,14H,3,12-13H2,1-2H3,(H,21,24)/t14-/m1/s1