3-ethyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-N-[(2-hydroxy-5-nitro-phenyl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-N-[(2-hydroxy-5-nitrophenyl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-N-[(2-hydroxy-5-nitrophenyl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-N-(2-hydroxy-5-nitro-benzyl)-2,4-diketo-1H-quinazoline-7-carboxamide Formula: C18H16N4O6 MolecularWeight: 384.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)NC1=O

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)NC1=O

InChI

InChI=1S/C18H16N4O6/c1-2-21-17(25)13-5-3-10(8-14(13)20-18(21)26)16(24)19-9-11-7-12(22(27)28)4-6-15(11)23/h3-8,23H,2,9H2,1H3,(H,19,24)(H,20,26)