methyl 4-[(2-chloranyl-5-nitro-phenyl)methylidene]-2-methyl-5-oxidanylidene-1-propyl-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[(2-chloranyl-5-nitro-phenyl)methylidene]-2-methyl-5-oxidanylidene-1-propyl-pyrrole-3-carboxylate Openeye Name: methyl 4-[(2-chloro-5-nitro-phenyl)methylene]-2-methyl-5-oxo-1-propyl-pyrrole-3-carboxylate CAS Name: 4-[(2-chloro-5-nitrophenyl)methylidene]-2-methyl-5-oxo-1-propyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[(2-chloro-5-nitrophenyl)methylidene]-2-methyl-5-oxo-1-propylpyrrole-3-carboxylate Traditional Name: 4-(2-chloro-5-nitro-benzylidene)-5-keto-2-methyl-1-propyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C17H17ClN2O5 MolecularWeight: 364.78028

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C1=O)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C(C(=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C1=O)C(=O)OC)C

InChI

InChI=1S/C17H17ClN2O5/c1-4-7-19-10(2)15(17(22)25-3)13(16(19)21)9-11-8-12(20(23)24)5-6-14(11)18/h5-6,8-9H,4,7H2,1-3H3