(4-azanylquinazolin-2-yl)methyl adamantane-1-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl adamantane-1-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C20H23N3O2 MolecularWeight: 337.41552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C20H23N3O2/c21-18-15-3-1-2-4-16(15)22-17(23-18)11-25-19(24)20-8-12-5-13(9-20)7-14(6-12)10-20/h1-4,12-14H,5-11H2,(H2,21,22,23)