O2-[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(5-chloro-2-nitro-anilino)-2-oxo-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(5-chloro-2-nitroanilino)-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-(5-chloro-2-nitroanilino)-2-oxoethyl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(5-chloro-2-nitro-anilino)-2-keto-ethyl] ester O4-methyl ester Formula: C17H16ClN3O7 MolecularWeight: 409.77784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O7/c1-8-14(16(23)27-3)9(2)19-15(8)17(24)28-7-13(22)20-11-6-10(18)4-5-12(11)21(25)26/h4-6,19H,7H2,1-3H3,(H,20,22)