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

Systemtic Name: 4-nitro-N-[(2S)-4-oxidanylidene-2-phenyl-1,2-dihydroquinazolin-3-yl]benzamide Openeye Name: 4-nitro-N-[(2S)-4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl]benzamide CAS Name: 4-nitro-N-[(2S)-4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl]benzamide IUPAC Name: 4-nitro-N-[(2S)-4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl]benzamide Traditional Name: N-[(2S)-4-keto-2-phenyl-1,2-dihydroquinazolin-3-yl]-4-nitro-benzamide Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N4O4/c26-20(15-10-12-16(13-11-15)25(28)29)23-24-19(14-6-2-1-3-7-14)22-18-9-5-4-8-17(18)21(24)27/h1-13,19,22H,(H,23,26)/t19-/m0/s1