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

Systemtic Name: methyl 4-[2-(2-methoxy-5-nitro-phenoxy)ethanoylamino]butanoate Openeye Name: methyl 4-[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]butanoate CAS Name: 4-[[2-(2-methoxy-5-nitrophenoxy)-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-methoxy-5-nitrophenoxy)acetyl]amino]butanoate Traditional Name: 4-[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]butyric acid methyl ester Formula: C14H18N2O7 MolecularWeight: 326.30192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NCCCC(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NCCCC(=O)OC

InChI

InChI=1S/C14H18N2O7/c1-21-11-6-5-10(16(19)20)8-12(11)23-9-13(17)15-7-3-4-14(18)22-2/h5-6,8H,3-4,7,9H2,1-2H3,(H,15,17)