3-[[2-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-3-nitro-phenyl]methylideneamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[[2-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-3-nitro-phenyl]methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[[2-(2-morpholino-2-oxo-ethoxy)-3-nitro-phenyl]methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[[2-[2-(4-morpholinyl)-2-oxoethoxy]-3-nitrophenyl]methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[[2-(2-morpholin-4-yl-2-oxoethoxy)-3-nitrophenyl]methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[[2-(2-keto-2-morpholino-ethoxy)-3-nitro-benzylidene]amino]-1H-quinazoline-2,4-quinone Formula: C21H19N5O7 MolecularWeight: 453.40486

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC2=C(C=CC=C2[N+](=O)[O-])C=NN3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

C1COCCN1C(=O)COC2=C(C=CC=C2[N+](=O)[O-])C=NN3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H19N5O7/c27-18(24-8-10-32-11-9-24)13-33-19-14(4-3-7-17(19)26(30)31)12-22-25-20(28)15-5-1-2-6-16(15)23-21(25)29/h1-7,12H,8-11,13H2,(H,23,29)