[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-(dimethylamino)-5-nitro-benzoate

Systemtic Name: [3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-(dimethylamino)-5-nitro-benzoate Openeye Name: [3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]methyl 2-(dimethylamino)-5-nitro-benzoate CAS Name: 2-(dimethylamino)-5-nitrobenzoic acid [3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]methyl 2-(dimethylamino)-5-nitrobenzoate Traditional Name: 2-(dimethylamino)-5-nitro-benzoic acid [3-(2-furfuryl)-4-keto-quinazolin-2-yl]methyl ester Formula: C23H20N4O6 MolecularWeight: 448.4281

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C23H20N4O6/c1-25(2)20-10-9-15(27(30)31)12-18(20)23(29)33-14-21-24-19-8-4-3-7-17(19)22(28)26(21)13-16-6-5-11-32-16/h3-12H,13-14H2,1-2H3