ethyl 1-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(6-bromo-4-oxo-quinazolin-3-yl)propanoyl]piperidine-4-carboxylate CAS Name: 1-[3-(6-bromo-4-oxo-3-quinazolinyl)-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(6-bromo-4-oxoquinazolin-3-yl)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(6-bromo-4-keto-quinazolin-3-yl)propanoyl]isonipecotic acid ethyl ester Formula: C19H22BrN3O4 MolecularWeight: 436.29968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C19H22BrN3O4/c1-2-27-19(26)13-5-8-22(9-6-13)17(24)7-10-23-12-21-16-4-3-14(20)11-15(16)18(23)25/h3-4,11-13H,2,5-10H2,1H3