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

Systemtic Name: 3-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-3-nitro-phenyl]methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[[4-(2-morpholino-2-oxo-ethoxy)-3-nitro-phenyl]methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[[4-[2-(4-morpholinyl)-2-oxoethoxy]-3-nitrophenyl]methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[[4-(2-morpholin-4-yl-2-oxoethoxy)-3-nitrophenyl]methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[[4-(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=C(C=C2)C=NN3C(=O)C4=CC=CC=C4NC3=O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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