methyl 4-[3-[2-(2-methoxy-5-nitro-phenoxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]butanoate

Systemtic Name: methyl 4-[3-[2-(2-methoxy-5-nitro-phenoxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]butanoate Openeye Name: methyl 4-[3-[2-(2-methoxy-5-nitro-phenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]butanoate CAS Name: 4-[3-[2-(2-methoxy-5-nitrophenoxy)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-[2-(2-methoxy-5-nitrophenoxy)acetyl]-2,5-dimethylpyrrol-1-yl]butanoate Traditional Name: 4-[3-[2-(2-methoxy-5-nitro-phenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]butyric acid methyl ester Formula: C20H24N2O7 MolecularWeight: 404.41376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCC(=O)OC)C)C(=O)COC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(N1CCCC(=O)OC)C)C(=O)COC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H24N2O7/c1-13-10-16(14(2)21(13)9-5-6-20(24)28-4)17(23)12-29-19-11-15(22(25)26)7-8-18(19)27-3/h7-8,10-11H,5-6,9,12H2,1-4H3