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

Systemtic Name: methyl 4-[2,5-dimethyl-3-[2-(2-nitrophenoxy)ethanoyl]pyrrol-1-yl]butanoate Openeye Name: methyl 4-[2,5-dimethyl-3-[2-(2-nitrophenoxy)acetyl]pyrrol-1-yl]butanoate CAS Name: 4-[2,5-dimethyl-3-[2-(2-nitrophenoxy)-1-oxoethyl]-1-pyrrolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[2,5-dimethyl-3-[2-(2-nitrophenoxy)acetyl]pyrrol-1-yl]butanoate Traditional Name: 4-[2,5-dimethyl-3-[2-(2-nitrophenoxy)acetyl]pyrrol-1-yl]butyric acid methyl ester Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6/c1-13-11-15(14(2)20(13)10-6-9-19(23)26-3)17(22)12-27-18-8-5-4-7-16(18)21(24)25/h4-5,7-8,11H,6,9-10,12H2,1-3H3