[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(2-methyl-5-propan-2-yl-phenoxy)ethanoate

Systemtic Name: [2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(2-methyl-5-propan-2-yl-phenoxy)ethanoate Openeye Name: [2-(4-nitroanilino)-2-oxo-ethyl] 2-(5-isopropyl-2-methyl-phenoxy)acetate CAS Name: 2-(2-methyl-5-propan-2-ylphenoxy)acetic acid [2-(4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-nitroanilino)-2-oxoethyl] 2-(2-methyl-5-propan-2-ylphenoxy)acetate Traditional Name: 2-(5-isopropyl-2-methyl-phenoxy)acetic acid [2-keto-2-(4-nitroanilino)ethyl] ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)OCC(=O)OCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)OCC(=O)OCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-13(2)15-5-4-14(3)18(10-15)27-12-20(24)28-11-19(23)21-16-6-8-17(9-7-16)22(25)26/h4-10,13H,11-12H2,1-3H3,(H,21,23)