2-(4-oxidanylidenequinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide

Systemtic Name: 2-(4-oxidanylidenequinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide Openeye Name: 2-(4-oxoquinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide CAS Name: 2-(4-oxo-3-quinazolinyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)acetamide IUPAC Name: 2-(4-oxoquinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylacetamide Traditional Name: 2-(4-ketoquinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C22H21N3O4/c26-20(13-25-14-23-17-7-3-2-6-16(17)21(25)27)24-15-8-9-18-19(12-15)29-22(28-18)10-4-1-5-11-22/h2-3,6-9,12,14H,1,4-5,10-11,13H2,(H,24,26)