N-(1-adamantyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-(1-adamantyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(1-adamantyl)-2-(6-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(1-adamantyl)-2-(6-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(1-adamantyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(1-adamantyl)-2-(4-keto-6-nitro-quinazolin-3-yl)acetamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CN4C=NC5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CN4C=NC5=C(C4=O)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4/c25-18(22-20-7-12-3-13(8-20)5-14(4-12)9-20)10-23-11-21-17-2-1-15(24(27)28)6-16(17)19(23)26/h1-2,6,11-14H,3-5,7-10H2,(H,22,25)