methyl 4-[[2-(2-methoxy-5-nitro-phenoxy)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(2-methoxy-5-nitro-phenoxy)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(2-methoxy-5-nitrophenoxy)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(2-methoxy-5-nitrophenoxy)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]methyl]benzoic acid methyl ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H18N2O7/c1-25-15-8-7-14(20(23)24)9-16(15)27-11-17(21)19-10-12-3-5-13(6-4-12)18(22)26-2/h3-9H,10-11H2,1-2H3,(H,19,21)