methyl 2,4-dimethyl-5-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxoethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(4-nitro-1,3-dioxoisoindol-2-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H15N3O7 MolecularWeight: 385.3276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O7/c1-8-13(18(25)28-3)9(2)19-15(8)12(22)7-20-16(23)10-5-4-6-11(21(26)27)14(10)17(20)24/h4-6,19H,7H2,1-3H3