N-[(2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]-4-nitro-benzamide

Systemtic Name: N-[(2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]-4-nitro-benzamide Openeye Name: N-[(2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]-4-nitro-benzamide CAS Name: N-[(2S)-2-(4,5-dimethoxy-2-nitrophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]-4-nitrobenzamide IUPAC Name: N-[(2S)-2-(4,5-dimethoxy-2-nitrophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]-4-nitrobenzamide Traditional Name: N-[(2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-4-keto-1,2-dihydroquinazolin-3-yl]-4-nitro-benzamide Formula: C23H19N5O8 MolecularWeight: 493.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)[C@H]2NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])OC

InChI

InChI=1S/C23H19N5O8/c1-35-19-11-16(18(28(33)34)12-20(19)36-2)21-24-17-6-4-3-5-15(17)23(30)26(21)25-22(29)13-7-9-14(10-8-13)27(31)32/h3-12,21,24H,1-2H3,(H,25,29)/t21-/m0/s1