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

Systemtic Name: methyl 1-(3-methoxypropyl)-2-methyl-4-[(3-nitrophenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-(3-methoxypropyl)-2-methyl-4-[(3-nitrophenyl)methylene]-5-oxo-pyrrole-3-carboxylate CAS Name: 1-(3-methoxypropyl)-2-methyl-4-[(3-nitrophenyl)methylidene]-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-methoxypropyl)-2-methyl-4-[(3-nitrophenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: 5-keto-1-(3-methoxypropyl)-2-methyl-4-(3-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)15(17(21)19(12)8-5-9-25-2)11-13-6-4-7-14(10-13)20(23)24/h4,6-7,10-11H,5,8-9H2,1-3H3