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

Systemtic Name: [3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 4-(methylamino)-3-nitro-benzoate Openeye Name: [3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]methyl 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid [3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]methyl 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid [3-(2-furfuryl)-4-keto-quinazolin-2-yl]methyl ester Formula: C22H18N4O6 MolecularWeight: 434.40152

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O6/c1-23-18-9-8-14(11-19(18)26(29)30)22(28)32-13-20-24-17-7-3-2-6-16(17)21(27)25(20)12-15-5-4-10-31-15/h2-11,23H,12-13H2,1H3