N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-propyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-propyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-propyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-propyl-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-propyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-propyl-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H20ClN3O4/c1-2-9-25(21(27)18-12-28-16-5-3-4-6-17(16)29-18)11-19-23-15-10-13(22)7-8-14(15)20(26)24-19/h3-8,10,18H,2,9,11-12H2,1H3,(H,23,24,26)