2-[(5-chloranyl-2-morpholin-4-yl-phenyl)amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2-morpholin-4-yl-phenyl)amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide Openeye Name: 2-(5-chloro-2-morpholino-anilino)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: 2-[5-chloro-2-(4-morpholinyl)anilino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide IUPAC Name: 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-(5-chloro-2-morpholino-anilino)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CNC3=C(C=CC(=C3)Cl)N4CCOCC4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CNC3=C(C=CC(=C3)Cl)N4CCOCC4)OC1

InChI

InChI=1S/C21H24ClN3O4/c22-15-2-4-18(25-6-10-27-11-7-25)17(12-15)23-14-21(26)24-16-3-5-19-20(13-16)29-9-1-8-28-19/h2-5,12-13,23H,1,6-11,14H2,(H,24,26)