propan-2-yl 4-[2-(2-chloranyl-4-nitro-phenoxy)ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-(2-chloranyl-4-nitro-phenoxy)ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(2-chloro-4-nitrophenoxy)-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(2-chloro-4-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]benzoic acid isopropyl ester Formula: C18H17ClN2O6 MolecularWeight: 392.79038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H17ClN2O6/c1-11(2)27-18(23)12-3-5-13(6-4-12)20-17(22)10-26-16-8-7-14(21(24)25)9-15(16)19/h3-9,11H,10H2,1-2H3,(H,20,22)