N-(5-chloranyl-2-morpholin-4-yl-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-acetyl-N-(5-chloro-2-morpholino-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-acetyl-N-[5-chloro-2-(4-morpholinyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-acetyl-N-(5-chloro-2-morpholin-4-ylphenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-acetyl-N-(5-chloro-2-morpholino-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

Isomeric SMILES

CC(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

InChI

InChI=1S/C21H22ClN3O4/c1-14(26)25-13-20(29-19-5-3-2-4-18(19)25)21(27)23-16-12-15(22)6-7-17(16)24-8-10-28-11-9-24/h2-7,12,20H,8-11,13H2,1H3,(H,23,27)