3-[[3-chloranyl-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-5-nitro-phenyl]methylideneamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[[3-chloranyl-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-5-nitro-phenyl]methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[[3-chloro-4-(2-morpholino-2-oxo-ethoxy)-5-nitro-phenyl]methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[[3-chloro-4-[2-(4-morpholinyl)-2-oxoethoxy]-5-nitrophenyl]methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[[3-chloro-4-(2-morpholin-4-yl-2-oxoethoxy)-5-nitrophenyl]methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[[3-chloro-4-(2-keto-2-morpholino-ethoxy)-5-nitro-benzylidene]amino]-1H-quinazoline-2,4-quinone Formula: C21H18ClN5O7 MolecularWeight: 487.84992

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC2=C(C=C(C=C2Cl)C=NN3C(=O)C4=CC=CC=C4NC3=O)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)COC2=C(C=C(C=C2Cl)C=NN3C(=O)C4=CC=CC=C4NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN5O7/c22-15-9-13(11-23-26-20(29)14-3-1-2-4-16(14)24-21(26)30)10-17(27(31)32)19(15)34-12-18(28)25-5-7-33-8-6-25/h1-4,9-11H,5-8,12H2,(H,24,30)