(4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(1-adamantyl)ethanoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(1-adamantyl)ethanoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(1-adamantyl)acetate CAS Name: 2-(1-adamantyl)acetic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(1-adamantyl)acetate Traditional Name: 2-(1-adamantyl)acetic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)OCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)OCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C21H24N2O3/c24-19(11-21-8-13-5-14(9-21)7-15(6-13)10-21)26-12-18-22-17-4-2-1-3-16(17)20(25)23-18/h1-4,13-15H,5-12H2,(H,22,23,25)