2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide

Systemtic Name: 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide Openeye Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide CAS Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide IUPAC Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide Traditional Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-acetamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CC3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CC3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C21H20ClN3O4/c1-25(12-18-23-16-6-3-2-5-14(16)21(27)24-18)19(26)11-13-9-15(22)20-17(10-13)28-7-4-8-29-20/h2-3,5-6,9-10H,4,7-8,11-12H2,1H3,(H,23,24,27)