N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3)OC1

InChI

InChI=1S/C20H19N3O4/c24-19(21-13-6-7-16-17(12-13)27-11-3-10-26-16)9-8-18-22-15-5-2-1-4-14(15)20(25)23-18/h1-2,4-7,12H,3,8-11H2,(H,21,24)(H,22,23,25)