dimethyl 5-[2-(4-chloranyl-2-nitro-phenoxy)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(4-chloranyl-2-nitro-phenoxy)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(4-chloro-2-nitro-phenoxy)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(4-chloro-2-nitrophenoxy)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(4-chloro-2-nitrophenoxy)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(4-chloro-2-nitro-phenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H15ClN2O8 MolecularWeight: 422.7733

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O8/c1-27-17(23)10-5-11(18(24)28-2)7-13(6-10)20-16(22)9-29-15-4-3-12(19)8-14(15)21(25)26/h3-8H,9H2,1-2H3,(H,20,22)