methyl (4Z)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxidanylidene-1-propyl-pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxidanylidene-1-propyl-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-2-methyl-4-[(4-nitrophenyl)methylene]-5-oxo-1-propyl-pyrrole-3-carboxylate CAS Name: (4Z)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxo-1-propyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxo-1-propylpyrrole-3-carboxylate Traditional Name: (4Z)-5-keto-2-methyl-4-(4-nitrobenzylidene)-1-propyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5/c1-4-9-18-11(2)15(17(21)24-3)14(16(18)20)10-12-5-7-13(8-6-12)19(22)23/h5-8,10H,4,9H2,1-3H3/b14-10-