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

Systemtic Name: methyl 1-(3-methoxypropyl)-2-methyl-4-[(2-nitrophenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-(3-methoxypropyl)-2-methyl-4-[(2-nitrophenyl)methylene]-5-oxo-pyrrole-3-carboxylate CAS Name: 1-(3-methoxypropyl)-2-methyl-4-[(2-nitrophenyl)methylidene]-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-methoxypropyl)-2-methyl-4-[(2-nitrophenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: 5-keto-1-(3-methoxypropyl)-2-methyl-4-(2-nitrobenzylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=CC=C2[N+](=O)[O-])C(=O)N1CCCOC)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC2=CC=CC=C2[N+](=O)[O-])C(=O)N1CCCOC)C(=O)OC

InChI

InChI=1S/C18H20N2O6/c1-12-16(18(22)26-3)14(17(21)19(12)9-6-10-25-2)11-13-7-4-5-8-15(13)20(23)24/h4-5,7-8,11H,6,9-10H2,1-3H3