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

Systemtic Name: methyl 3-[2,5-dimethyl-3-[2-(4-nitrophenoxy)ethanoyl]pyrrol-1-yl]propanoate Openeye Name: methyl 3-[2,5-dimethyl-3-[2-(4-nitrophenoxy)acetyl]pyrrol-1-yl]propanoate CAS Name: 3-[2,5-dimethyl-3-[2-(4-nitrophenoxy)-1-oxoethyl]-1-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2,5-dimethyl-3-[2-(4-nitrophenoxy)acetyl]pyrrol-1-yl]propanoate Traditional Name: 3-[2,5-dimethyl-3-[2-(4-nitrophenoxy)acetyl]pyrrol-1-yl]propionic acid methyl ester Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(=O)OC)C)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CCC(=O)OC)C)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O6/c1-12-10-16(13(2)19(12)9-8-18(22)25-3)17(21)11-26-15-6-4-14(5-7-15)20(23)24/h4-7,10H,8-9,11H2,1-3H3