3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylpropanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propionamide Formula: C22H20BrN3O4 MolecularWeight: 470.3159

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CCN4C=NC5=C(C4=O)C=C(C=C5)Br

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CCN4C=NC5=C(C4=O)C=C(C=C5)Br

InChI

InChI=1S/C22H20BrN3O4/c23-14-3-5-17-16(11-14)21(28)26(13-24-17)10-7-20(27)25-15-4-6-18-19(12-15)30-22(29-18)8-1-2-9-22/h3-6,11-13H,1-2,7-10H2,(H,25,27)