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

Systemtic Name: methyl (4Z)-1-[(2S)-butan-2-yl]-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-2-methyl-1-[(1S)-1-methylpropyl]-4-[(4-nitrophenyl)methylene]-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-1-[(2S)-butan-2-yl]-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-1-[(2S)-butan-2-yl]-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-5-keto-2-methyl-1-[(1S)-1-methylpropyl]-4-(4-nitrobenzylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=C(C(=CC2=CC=C(C=C2)[N+](=O)[O-])C1=O)C(=O)OC)C

Isomeric SMILES

CC[C@H](C)N1C(=C(/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C1=O)C(=O)OC)C

InChI

InChI=1S/C18H20N2O5/c1-5-11(2)19-12(3)16(18(22)25-4)15(17(19)21)10-13-6-8-14(9-7-13)20(23)24/h6-11H,5H2,1-4H3/b15-10-/t11-/m0/s1