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

Systemtic Name: methyl 4-[[2-(4-chloranyl-2-nitro-phenoxy)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(4-chloro-2-nitro-phenoxy)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(4-chloro-2-nitrophenoxy)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(4-chloro-2-nitrophenoxy)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(4-chloro-2-nitro-phenoxy)acetyl]amino]methyl]benzoic acid methyl ester Formula: C17H15ClN2O6 MolecularWeight: 378.7638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN2O6/c1-25-17(22)12-4-2-11(3-5-12)9-19-16(21)10-26-15-7-6-13(18)8-14(15)20(23)24/h2-8H,9-10H2,1H3,(H,19,21)